#METABOLOMICS WORKBENCH WanshengChen_20230716_231058 DATATRACK_ID:4165 STUDY_ID:ST002795 ANALYSIS_ID:AN004547 PROJECT_ID:PR001743 VERSION 1 CREATED_ON July 26, 2023, 7:25 am #PROJECT PR:PROJECT_TITLE Functional divergence of CYP76AKs shapes the chemodiversity of abietane-type PR:PROJECT_TITLE diterpenoids in genus Salvia PR:PROJECT_SUMMARY The genus Salvia L. (Lamiaceae) comprises myriad distinct medicinal herbs, with PR:PROJECT_SUMMARY terpenoids as one of their major active chemical groups. Abietane-type PR:PROJECT_SUMMARY diterpenoids (ATDs), such as tanshinones and carnosic acids, are specific to PR:PROJECT_SUMMARY Salvia and exhibit taxonomic chemical diversity among lineages. To elucidate how PR:PROJECT_SUMMARY ATD chemical diversity evolved, we carried out large-scale metabolic and PR:PROJECT_SUMMARY phylogenetic analyses of 71 Salvia species, combined with enzyme function, PR:PROJECT_SUMMARY ancestral sequence and chemical trait reconstruction, and comparative genomics PR:PROJECT_SUMMARY experiments. This integrated approach showed that the lineage-wide ATD PR:PROJECT_SUMMARY diversities in Salvia were induced by differences in the oxidation of the PR:PROJECT_SUMMARY terpenoid skeleton at C-20, which was caused by the functional divergence of the PR:PROJECT_SUMMARY cytochrome P450 subfamily CYP76AK. These findings present a unique pattern of PR:PROJECT_SUMMARY chemical diversity in plants that was shaped by the loss of enzyme activity and PR:PROJECT_SUMMARY associated catalytic pathways. PR:INSTITUTE Shanghai University of Traditional Chinese Medicine PR:LAST_NAME Chen PR:FIRST_NAME Wansheng PR:ADDRESS NO. 1200 Cailun Road PR:EMAIL chenwansheng@shutcm.edu.cn PR:PHONE (021)51322405 #STUDY ST:STUDY_TITLE Functional divergence of CYP76AKs shapes the chemodiversity of abietane-type ST:STUDY_TITLE diterpenoids in genus Salvia ST:STUDY_SUMMARY The genus Salvia L. (Lamiaceae) comprises myriad distinct medicinal herbs, with ST:STUDY_SUMMARY terpenoids as one of their major active chemical groups. Abietane-type ST:STUDY_SUMMARY diterpenoids (ATDs), such as tanshinones and carnosic acids, are specific to ST:STUDY_SUMMARY Salvia and exhibit taxonomic chemical diversity among lineages. To elucidate how ST:STUDY_SUMMARY ATD chemical diversity evolved, we carried out large-scale metabolic and ST:STUDY_SUMMARY phylogenetic analyses of 71 Salvia species, combined with enzyme function, ST:STUDY_SUMMARY ancestral sequence and chemical trait reconstruction, and comparative genomics ST:STUDY_SUMMARY experiments. This integrated approach showed that the lineage-wide ATD ST:STUDY_SUMMARY diversities in Salvia were induced by differences in the oxidation of the ST:STUDY_SUMMARY terpenoid skeleton at C-20, which was caused by the functional divergence of the ST:STUDY_SUMMARY cytochrome P450 subfamily CYP76AK. These findings present a unique pattern of ST:STUDY_SUMMARY chemical diversity in plants that was shaped by the loss of enzyme activity and ST:STUDY_SUMMARY associated catalytic pathways. ST:INSTITUTE Shanghai University of Traditional Chinese Medicine ST:LAST_NAME Chen ST:FIRST_NAME Wansheng ST:ADDRESS NO. 1200 Cailun Road ST:EMAIL chenwansheng@shutcm.edu.cn ST:PHONE 02151322405 #SUBJECT SU:SUBJECT_TYPE Plant SU:SUBJECT_SPECIES Salvia #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - Salvia-abrotanoides Taxon:Salvia abrotanoides RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-abrotanoides-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-adenophora Taxon:Salvia adenophora RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-adenophora-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-aerea Taxon:Salvia aerea RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-aerea-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-amplexicaulis Taxon:Salvia amplexicaulis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-amplexicaulis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-apiana Taxon:Salvia apiana RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-apiana-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-arborescens Taxon:Salvia arborescens RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-arborescens-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-argentea Taxon:Salvia argentea RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-argentea-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-azurea Taxon:Salvia azurea RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-azurea-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-bifidocalyx Taxon:Salvia bifidocalyx RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-bifidocalyx-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-biserrata Taxon:Salvia biserrata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-biserrata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-bowleyana-var-subbipinnata Taxon:Salvia bowleyana var subbipinnata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-bowleyana-var-subbipinnata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-bulleyana Taxon:Salvia bulleyana RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-bulleyana-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-candidissima Taxon:Salvia candidissima RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-candidissima-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-canescens-var-daghestanica Taxon:Salvia canescens var daghestanica RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-canescens-var-daghestanica-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-castanea Taxon:Salvia castanea RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-castanea-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-castanea-f-tomentosa Taxon:Salvia castanea f tomentosa RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-castanea-f-tomentosa-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-caudata Taxon:Salvia caudata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-caudata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-cavaleriei Taxon:Salvia cavaleriei RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-cavaleriei-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-chinensis Taxon:Salvia chinensis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-chinensis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-cinnabarina Taxon:Salvia cinnabarina RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-cinnabarina-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-circinnata Taxon:Salvia circinnata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-circinnata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-coccinea-Summer-Jewel-Pink Taxon:Salvia coccinea Summer Jewel Pink RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-coccinea-Summer-Jewel-Pink-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-coerulea Taxon:Salvia coerulea RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-coerulea-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-columbariae Taxon:Salvia columbariae RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-columbariae-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-cynica Taxon:Salvia cynica RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-cynica-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-deserta Taxon:Salvia deserta RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-deserta-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-digitaloides Taxon:Salvia digitaloides RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-digitaloides-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-elegans Taxon:Salvia elegans RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-elegans-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-farinacea-Fairy-Queen Taxon:Salvia farinacea Fairy Queen RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-farinacea-Fairy-Queen-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-flava-var-megalantha Taxon:Salvia flava var megalantha RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-flava-var-megalantha-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-hispanica Taxon:Salvia hispanica RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-hispanica-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-iodantha Taxon:Salvia iodantha RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-iodantha-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-jurisicii Taxon:Salvia jurisicii RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-jurisicii-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-karwinskii Taxon:Salvia karwinskii RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-karwinskii-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-leucantha Taxon:Salvia leucantha RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-leucantha-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-lyrata Taxon:Salvia lyrata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-lyrata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-madrensis Taxon:Salvia madrensis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-madrensis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-mexicana Taxon:Salvia mexicana RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-mexicana-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-miltiorrhiza Taxon:Salvia miltiorrhiza RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-miltiorrhiza-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-miniata Taxon:Salvia miniata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-miniata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-Mystic-Spires-Blue Taxon:Salvia Mystic Spires Blue RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-Mystic-Spires-Blue-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-namaensis Taxon:Salvia namaensis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-namaensis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-nutans Taxon:Salvia nutans RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-nutans-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-officinalis Taxon:Salvia officinalis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-officinalis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-officinalis-subsp-lavandulifolia Taxon:Salvia officinalis subsp lavandulifolia RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-officinalis-subsp-lavandulifolia-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-pachyphylla Taxon:Salvia pachyphylla RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-pachyphylla-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-plebeia Taxon:Salvia plebeia RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-plebeia-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-pratensis Taxon:Salvia pratensis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-pratensis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-prionitis Taxon:Salvia prionitis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-prionitis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-przewalskii Taxon:Salvia przewalskii RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-przewalskii-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-recognita Taxon:Salvia recognita RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-recognita-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-roborowskii Taxon:Salvia roborowskii RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-roborowskii-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-roemeriana Taxon:Salvia roemeriana RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-roemeriana-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-roscida Taxon:Salvia roscida RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-roscida-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-rosmarinus Taxon:Salvia rosmarinus RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-rosmarinus-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-rypara Taxon:Salvia rypara RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-rypara-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-sclarea Taxon:Salvia sclarea RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-sclarea-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-sclarea-var-turkestanica-Vatican-Pink Taxon:Salvia sclarea var turkestanica Vatican Pink RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-sclarea-var-turkestanica-Vatican-Pink-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-semiatrata Taxon:Salvia semiatrata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-semiatrata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-splendens Taxon:Salvia splendens RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-splendens-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-subpalmatinervis Taxon:Salvia subpalmatinervis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-subpalmatinervis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-tiliifolia Taxon:Salvia tiliifolia RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-tiliifolia-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-tricuspis Taxon:Salvia tricuspis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-tricuspis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-trijuga Taxon:Salvia trijuga RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-trijuga-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-tubifera Taxon:Salvia tubifera RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-tubifera-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-uliginosa Taxon:Salvia uliginosa RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-uliginosa-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-urica Taxon:Salvia urica RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-urica-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-verticillata Taxon:Salvia verticillata RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-verticillata-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-viridis Taxon:Salvia viridis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-viridis-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-wagneriana Taxon:Salvia wagneriana RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-wagneriana-1/2/3.mzML SUBJECT_SAMPLE_FACTORS - Salvia-yunnanensis Taxon:Salvia yunnanensis RAW_FILE_NAME=POS/NEG-Leaf/Root-Salvia-yunnanensis-1/2/3.mzML #COLLECTION CO:COLLECTION_SUMMARY Samples were collected from live mature plants and separated into root and leaf CO:COLLECTION_SUMMARY samples, with 3 biological replicates. Then samples were frozen in liquid CO:COLLECTION_SUMMARY nitrogen. The 2 parts of each plant were crushed into homogeneous powders CO:COLLECTION_SUMMARY respectively. In total, 71 species from three major distribution centers for CO:COLLECTION_SUMMARY this genus representing 8 out of the 11 recognized subclades of Salvia were CO:COLLECTION_SUMMARY sampled. To obtain sufficient materials for both chemical analyses, samples were CO:COLLECTION_SUMMARY collected at the vegetative or flowering stages. CO:SAMPLE_TYPE Plant #TREATMENT TR:TREATMENT_SUMMARY No treatment, just species difference. In total, 71 species from three major TR:TREATMENT_SUMMARY distribution centers for this genus representing 8 out of the 11 recognized TR:TREATMENT_SUMMARY subclades of Salvia were sampled. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY All samples were ground into a fine powder, and 10 mg prepared powder was SP:SAMPLEPREP_SUMMARY extracted with 1 mL of 70% methanol (v/v) containing warfarin (5 μg/mL) as the SP:SAMPLEPREP_SUMMARY internal reference for 1 h in an ultrasonic bath (53 kHz, 350 W) at 4 °C. After SP:SAMPLEPREP_SUMMARY centrifuging at 12,000 g at 4 °C for 30 min, the supernatant was used for SP:SAMPLEPREP_SUMMARY UHPLC-QTOF-MS analysis. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Waters Acquity CH:COLUMN_NAME Waters ACQUITY UPLC HSS T3 (100 x 2.1mm,1.8um) CH:SOLVENT_A 100% water; 0.1% formic acid CH:SOLVENT_B 100% acetonitrile; 0.1% formic acid CH:FLOW_GRADIENT The elution gradients were 98–80% A over 0–7 min, 80–78% A over 7–11 CH:FLOW_GRADIENT min, 78–40% A over 11–20 min, 40–35% A over 20–25 min, 25–28 min at CH:FLOW_GRADIENT 35% A, 35–5% A over 28–30 min, 30–33 min at 5% A, and final CH:FLOW_GRADIENT re-equilibration at 98% A for 5 min. CH:FLOW_RATE 0.40 mL/min CH:COLUMN_TEMPERATURE 40 °C #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Waters Xevo-G2-XS MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE UNSPECIFIED MS:MS_COMMENTS MS-DIAL v4.60 software. The data in the results table represent the average MS:MS_COMMENTS values for roots and leaves. Positive and negative ion-mode data were combined MS:MS_COMMENTS in the results table #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Normalized peak height MS_METABOLITE_DATA_START Samples Salvia-abrotanoides Salvia-adenophora Salvia-aerea Salvia-amplexicaulis Salvia-apiana Salvia-arborescens Salvia-argentea Salvia-azurea Salvia-bifidocalyx Salvia-biserrata Salvia-bowleyana-var-subbipinnata Salvia-bulleyana Salvia-candidissima Salvia-canescens-var-daghestanica Salvia-castanea Salvia-castanea-f-tomentosa Salvia-caudata Salvia-cavaleriei Salvia-chinensis Salvia-cinnabarina Salvia-circinnata Salvia-coccinea-Summer-Jewel-Pink Salvia-coerulea Salvia-columbariae Salvia-cynica Salvia-deserta Salvia-digitaloides Salvia-elegans Salvia-farinacea-Fairy-Queen Salvia-flava-var-megalantha Salvia-hispanica Salvia-iodantha Salvia-jurisicii Salvia-karwinskii Salvia-leucantha Salvia-lyrata Salvia-madrensis Salvia-mexicana Salvia-miltiorrhiza Salvia-miniata Salvia-Mystic-Spires-Blue Salvia-namaensis Salvia-nutans Salvia-officinalis Salvia-officinalis-subsp-lavandulifolia Salvia-pachyphylla Salvia-plebeia Salvia-pratensis Salvia-prionitis Salvia-przewalskii Salvia-recognita Salvia-roborowskii Salvia-roemeriana Salvia-roscida Salvia-rosmarinus Salvia-rypara Salvia-sclarea Salvia-sclarea-var-turkestanica-Vatican-Pink Salvia-semiatrata Salvia-splendens Salvia-subpalmatinervis Salvia-tiliifolia Salvia-tricuspis Salvia-trijuga Salvia-tubifera Salvia-uliginosa Salvia-urica Salvia-verticillata Salvia-viridis Salvia-wagneriana Salvia-yunnanensis Factors Taxon:Salvia abrotanoides Taxon:Salvia adenophora Taxon:Salvia aerea Taxon:Salvia amplexicaulis Taxon:Salvia apiana Taxon:Salvia arborescens Taxon:Salvia argentea Taxon:Salvia azurea Taxon:Salvia bifidocalyx Taxon:Salvia biserrata Taxon:Salvia bowleyana var subbipinnata Taxon:Salvia bulleyana Taxon:Salvia candidissima Taxon:Salvia canescens var daghestanica Taxon:Salvia castanea Taxon:Salvia castanea f tomentosa Taxon:Salvia caudata Taxon:Salvia cavaleriei Taxon:Salvia chinensis Taxon:Salvia cinnabarina Taxon:Salvia circinnata Taxon:Salvia coccinea Summer Jewel Pink Taxon:Salvia coerulea Taxon:Salvia columbariae Taxon:Salvia cynica Taxon:Salvia deserta Taxon:Salvia digitaloides Taxon:Salvia elegans Taxon:Salvia farinacea Fairy Queen Taxon:Salvia flava var megalantha Taxon:Salvia hispanica Taxon:Salvia iodantha Taxon:Salvia jurisicii Taxon:Salvia karwinskii Taxon:Salvia leucantha Taxon:Salvia lyrata Taxon:Salvia madrensis Taxon:Salvia mexicana Taxon:Salvia miltiorrhiza Taxon:Salvia miniata Taxon:Salvia Mystic Spires Blue Taxon:Salvia namaensis Taxon:Salvia nutans Taxon:Salvia officinalis Taxon:Salvia officinalis subsp lavandulifolia Taxon:Salvia pachyphylla Taxon:Salvia plebeia Taxon:Salvia pratensis Taxon:Salvia prionitis Taxon:Salvia przewalskii Taxon:Salvia recognita Taxon:Salvia roborowskii Taxon:Salvia roemeriana Taxon:Salvia roscida Taxon:Salvia rosmarinus Taxon:Salvia rypara Taxon:Salvia sclarea Taxon:Salvia sclarea var turkestanica Vatican Pink Taxon:Salvia semiatrata Taxon:Salvia splendens Taxon:Salvia subpalmatinervis Taxon:Salvia tiliifolia Taxon:Salvia tricuspis Taxon:Salvia trijuga Taxon:Salvia tubifera Taxon:Salvia uliginosa Taxon:Salvia urica Taxon:Salvia verticillata Taxon:Salvia viridis Taxon:Salvia wagneriana Taxon:Salvia yunnanensis 7, 20-Dihydroxyabietaquinone 0.000460571 0 0 0.011487434 0.000775326 0.002453978 0.008296009 0 0 0 0 0 0 0.357855467 0 0 0.000607444 0 0 0.00147706 0 0 0 0 0 0.155198467 0 0.008030812 0 0 0 0 0 0 0 0 0.005422842 0 0.02302854 0 0 0 0 0 0 0.012025717 0 0 0 0.001494764 0 0 0.029264403 0.000428322 0.4280625 0.00312491 0 0 0 0 0 0 0 0.003006496 0 0 0 0 0.00041975 0 0.002707402 16, 20-Dihydroxyabietaquinone 0.137790372 0 0 0 0 0 0 0 0 0 0 0 0 0 0.007329578 0.002557053 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.034447593 0 0 0 0 0 0 0 0.001505347 0 0 0.009385114 0 0 0 0 0.172237965 0 0 0 0 0 0 0 0 0.02087887 0 0 0 0 0 0 0.002064825 7-Keto, 20-hydroxyabietaquinone 0 0 0 0.023827943 0 0 0 0 0 0 0 0 0 0 0.001486893 0.000480694 0 0 0 0 0 0 0 0 0.001222124 0 0 0 0 0 0 0 0 0 0 0 0 0 0.03655131 0 0 0 0 0 0 0.008063606 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.003599087 0 0 0 0 0 0 0.005980282 11, 20-Dihydroxysugiol 0 0 0 0 0 0 0 0.00063588 0 0 0.000771048 0.006668873 0 0 0 0.003236704 0 0 0.00562542 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.000313424 0 0.1461516 0 0.021358853 0 0 0 0 0 0 0 0 0 0.004867942 0 0 0.000785172 0.032352213 0 0 0 0 0 0 0.001846151 0 0 0 0.02655882 0 0.002049688 0 0.001436849 0 0 0 20-Hydroxyabietaquinone 0.144502574 0 0 0.113299723 0.002008258 0 0 0 0 0 0 0 0 0.1727625 0 0 0.000548485 0 0 0.000504759 0 0 0 0 0 0 0 0.002347507 0 0 0 0 0 0.002225187 0 0 0.195082767 0.000539976 0.072251287 0 0 0 0 0 0 0.034518273 0 0 0 0 0 0 0.123655133 0 0.343846033 0.011184069 0 0 0.001287554 0 0 0 0 0.001378778 0 0.000408233 0 0 0 0 0 Miltirone 0.27713 0.000352483 0.000915033 0.009555911 0.150598533 0.000852136 0.00779077 0.000422551 0.001779253 0.000537154 0.001491634 0.002518636 0.027852283 0.927700467 0.066612353 0.007714379 0.001327735 0.002118642 0.001904857 0.014763693 0.000601624 0.000410322 0.000663305 0.001513806 0.009317359 0.001875681 0.007506455 0.055035843 0.000383585 0.001708767 0.000799169 0.00082047 0.001018138 0.000556277 0.000997772 0.001129996 0.051859883 0.000761094 0.763382533 0.000873931 0.000974331 0.005067314 0.00084064 0.001121669 0.003090087 1.500633 0.000726009 0.001587862 0.001037808 0.034034664 0.001168564 0.00490341 0.208135333 0.001071588 1.436273 0.262793133 0.001496517 0.004083827 0.000526158 0.000461725 0.003423728 0.000742154 0.000642759 0.028863467 0.004740545 0.005482431 0.000958324 0.000778029 0.003548152 0.000295663 0.048525433 Cryptotanshinone 6.09702 0.000342082 0.04866985 0.000541708 1.674201667 0.000261477 0.000313429 0.000981192 0.030008327 0.00064193 0.01694729 0.06894989 0.002063362 0.000972716 3.228672333 1.580839667 0.00029622 0.015220309 0.044812483 0.000647006 0.000510178 0.000284197 0.000194715 0.635433167 0.1797594 0.004171921 0.095863577 0.001043353 0.000713967 0.029882837 0.00107576 0.000341898 0.000496933 0.000361013 0.005700314 0.000720096 0.00029462 0.000246928 12.19404 0.000297708 0.001284803 0.000297065 0.001038104 0.000439101 0.002606548 3.663967667 0.058743323 0.001734835 0.004310268 3.66942 0.000515929 0.366152367 0.001553664 0.001871133 4.599041667 0.000417489 0.000528841 0.000215047 0.001330825 0.002847198 0.074761987 0.000638431 0.037634147 9.093597 0.000599245 0.000403229 0.000327313 0.001051368 0.002491399 0.000151442 1.708186667 Tanshinone IIA 0 0.000187826 0.004545017 0.000101985 0.002698303 7.28E-05 0.000235538 0.000116193 0.008427031 0.000461867 0.003172663 0.039783173 8.32E-05 8.18E-05 2.170210333 1.618103 0.000152079 0.000926237 0.004008878 0.000145763 0.000130848 0.000128784 0.000116371 0.00178871 0.024495007 0.000633917 0.056217687 7.01E-05 8.75E-05 0 0.000180795 0.000144124 3.61E-05 0.000108275 0.000841445 0.000129685 0.000100668 0.000177641 2.812086333 0.000112147 0.000621313 0.000128138 0.00020758 0.000229646 0.000160764 0.007932244 0.00047475 0.00029535 0.002359623 2.275599 6.96E-05 0.015862533 0.000248753 0.000439733 0.006375422 0.000253131 0.000292407 8.37E-05 0.001375527 0.000299444 0.004751821 0.000212436 0.001709611 1.205178 0.000222545 0.000196024 0.000181708 0.000209372 0.000319705 5.51E-05 1.494597667 1, 2-Dihydrotanshinquinone 0 0.001787957 0.003971345 0.002204286 0.001848602 0.001761036 0.0019674 0.000964878 0.005158675 0.001815213 0.01643651 0.026701513 0.001506499 0.001525158 1.2778792 1.059557233 0.001939914 0.02334983 0.004755801 0.002182559 0.001138475 0.002118445 0.001425937 0.002130374 0.012601295 0.002351538 0.008467983 0.001381167 0.001771902 0.012601295 0.001916754 0.002015148 0.001596711 0.001570007 0.001990002 0.001832559 0.001724844 0.002227719 2.064407333 0.000898176 0.002190413 0.002059166 0.000528585 0.002526056 0.001706343 0.001816214 0.002372384 0.002223465 0.004205901 1.627624333 0.001900238 0.036435333 0.002566232 0.002088403 0.001734052 0.001804387 0.001795387 0.001875492 0.00340332 0.001827084 0.00772287 0.001820277 0.007317047 0.575122067 0.001834216 0.002527533 0.002234195 0.001251646 0.002164305 0.001837475 1.677089333 Dihydrotanshinone I 0 0.000662466 0.003880692 0 0 0 0.000818232 0 0.006932652 0.001251668 0.015323887 0.002378823 0.001025705 0.000506036 0.02489094 0.045855773 0.001143935 0.003977689 0.001457894 0.000326404 0 0 0.000858793 0.000464847 0.05693132 0.00120325 0.04797549 0.000339153 0.000943976 0 0.001307646 0 0 0 0 0 0.000671585 0.000470723 0.224565333 0.000870693 0 0 0.001248136 0 0.000552214 0.00040791 0.011376406 0.001032624 0.001102468 0.1677514 0.001055701 0.081807103 0.0010768 0.000455378 0.001291769 0 0.000509653 0 0.000600018 0.000531531 0.016884941 0 0.009702377 0.226388667 0 0.0003782 0.000497672 0 0.000362154 0 0.077555543 Methylenetanshinquinone 0 7.99E-05 0.002460077 9.57E-05 0.000154856 8.18E-05 0.000178885 0.000176487 0.004734735 8.72E-05 0.010521233 0.006062652 4.13E-05 0.000136405 0.278298 0.206658833 6.18E-05 0.017929177 0.003465711 0.000100875 9.56E-05 0.000105256 6.65E-05 5.35E-05 0.024293757 0.000607584 0.016244337 5.72E-05 8.97E-05 0.003303057 0.000167103 0.000197601 0.000177753 5.48E-05 0.000573507 0.000341077 0.000133827 0.000217111 1.179172333 0.000142105 0.000108993 0.00010154 0.000199062 0.000209117 0.000181267 0.00028093 0.02034667 0.000316699 0.000492765 0.5731262 0.000165345 0.2214883 0.000254047 0.000287576 0.000172913 7.78E-05 0.000122272 0.000101584 9.79E-05 0.000333783 0.013340232 9.82E-05 0.029110675 1.412258333 0.000130314 0.000142181 0.000139863 0.000139847 0.0002369 6.41E-05 0.218210467 Tanshinone I 0 4.49E-05 6.40E-05 6.79E-05 5.33E-05 5.97E-05 0.000110811 4.34E-05 6.99E-05 7.50E-05 4.68E-05 5.57E-05 6.75E-05 3.47E-05 0.100772303 0.147949133 5.53E-05 6.37E-05 5.66E-05 8.73E-05 5.65E-05 5.74E-05 2.46E-05 4.60E-05 0.000171721 0.00012314 7.30E-05 6.19E-05 5.81E-05 6.32E-05 2.96E-05 2.92E-05 3.17E-05 4.82E-05 6.02E-05 3.33E-05 5.07E-05 5.09E-05 0.343404067 5.32E-05 3.45E-05 5.55E-05 5.10E-05 0.000118801 5.03E-05 6.37E-05 9.27E-05 0.000115969 6.90E-05 0.440760533 6.97E-05 6.60E-05 4.50E-05 6.96E-05 8.47E-05 3.84E-05 0.000105888 8.55E-05 5.98E-05 7.03E-05 6.85E-05 4.36E-05 2.67E-05 0.270636033 8.20E-05 0.000105999 6.65E-05 6.61E-05 8.25E-05 4.96E-05 0.212144333 Przewaquinone C 0 1.97E-05 0.000183638 0.000160023 3.37E-05 5.75E-05 7.26E-05 4.27E-05 0.000129027 3.35E-05 0.000307166 7.16E-05 3.45E-05 3.53E-05 0.00821246 0.010407187 5.44E-05 9.89E-05 0.000202347 3.71E-05 5.40E-05 7.29E-05 2.47E-05 2.16E-05 0.000371084 0 0.000165408 3.77E-05 3.96E-05 0.000371084 9.45E-05 4.10E-05 3.11E-05 7.81E-05 2.30E-05 3.20E-05 0.000180078 6.25E-05 0.081085257 5.64E-05 4.81E-05 5.72E-05 4.47E-05 0.000134917 6.60E-05 0.000030998 9.86E-05 1.02E-05 5.50E-05 0.03419812 3.83E-05 0.000340336 7.03E-05 4.37E-05 8.03E-05 2.30E-05 2.02E-05 2.90E-05 6.68E-05 6.18E-05 0.000162451 4.32E-05 8.13E-05 0.023218397 2.90E-05 6.97E-05 4.18E-05 3.18E-05 7.77E-05 4.10E-05 0.011751859 7-Keto-royleanone 0.074077299 0.004428568 0.001973396 1.649977667 0.112913167 0.006738266 2.304575333 0.01936633 0.000635347 0.005856476 0.012322513 0.011306578 1.022985033 1.701462667 0.009109699 0.015115883 0.005336709 0.006582364 0.006554685 0.2376447 0.002806694 0.003766117 0.003433551 0 0.00417816 14.24200667 0.003743288 0.070136863 0.001394005 0 0.007627713 0.00468035 1.544016 0.028019053 0.0029696 0.037656997 0.198964167 0.003842872 0.024692433 0.002614416 0.002845324 0.006236638 2.221534333 0.381217767 0.041407237 1.196264 0.004637089 2.309857333 0.00987174 0.008401527 0.015266369 0.00919945 0.141999333 0.011186097 13.75136667 0.576884167 0.336730667 0.832274067 0.252516133 0.013736286 0.005324443 0.002845378 0.003348468 0.024520887 0.002337839 0.020916087 0.006840791 0.014023251 0.153268133 0.004798712 0.01515916 Royleanone 0.0245 0.00179875 0 0 0.04265644 0 0 0 0 0 0.003145998 0.002623874 0.279865233 1.955414 0 0.002005214 0 0.000945158 0 0.082531493 0 0 0 0 0 1.781177333 0 0 0 0 0 0 0.760216533 0 0 0.015601168 0 0 0.02321008 0 0 0 0.7886495 0.103348187 0.006291648 0.411124033 0 0.878971767 0 0 0.006464557 0 0 0 1.556734333 0.097596543 0 0 0.062834907 0 0 0 0 0.024167307 0 0 0 0 0.058538453 0 0.1598673 11-Hydroxysugiol 0.027 0.005954137 0.000452461 1.355116667 0.131502033 0.009612562 3.416695 0.004415729 0.001606878 0.066193453 0.002256429 0.009806272 2.360400333 0 0.01701094 0.007495285 0.009866966 0.000834094 0.002793447 0.517190067 0.070873283 0.000507127 0.002057344 0.010566286 0.013804923 8.390743667 0.007135115 0.233791267 0 0 0.00534534 0.000573972 1.823742667 0.045241677 0.004468832 0.558502267 2.349686667 0.013218493 0 0.00606888 0.001800085 0 4.593801667 0.808507633 0.1692281 2.709680333 0.001348285 2.695908333 0.002068431 0.028210673 0.08184808 0.008540705 0.083052467 0.004713337 7.315577333 0.203867733 0.1159738 0.308587867 0.610557433 0.128636517 0.004272438 0.004458262 0.004631605 0 0.003632696 0.03364299 0.025759547 0.006957834 0.1883643 0.004697193 0.011777927 7-Hydroxyroyleanone 0 0 0 0.815469033 0.044796303 0.007822047 0.536874367 0.003755519 0 0.001853222 0.001911028 0.003827557 0.514542667 0.046366927 0.003748102 0.003830429 0 0.000901101 0.001622917 0.1773375 0 0.001090642 0 0 0.001037577 3.900001 0.002438709 0.059776513 0.001363187 0 0.000827616 0 0.422570267 0.008451472 0.0006904 0.020903303 0.1216194 0.000714932 0.021520007 0.000484748 0 0.000454675 0.641921667 0.3190257 0.015449473 0.8896918 0.000397123 0.810106633 0.000853858 0.005983235 0.005843002 0.000991442 0.0712237 0.003767352 6.950563667 0.695436133 0.020339643 0.046981943 0.3270896 0.005837511 0 0.001744254 0.000530329 0.01104151 0.000960046 0.004485176 0.00105607 0.001698277 0.1716001 0 0.02394041 6-Hydroxyroyleanone 0 0 0 0.287128733 0 0 0.9783761 0 0 0 0 0.001444996 0.210578133 0.012061867 0 0 0 0 0 0 0 0 0 0 0 1.382324667 0 0 0 0 0 0 0.125970667 0 0 0 0.008274091 0 0.000538561 0 0 0 0.100110957 0.276291533 0.015192447 0.0371507 0 0.310152367 0 0 0.005475284 0 0.08487305 0.001300657 0.156137967 0.016147803 0.312468 0.804232333 0.009431007 0 0 0 0 0.000678547 0 0 0 0 0.006215224 0 0.002923875 6-Keto-11-hydroxysugiol 0 0 0 0.126659567 0.00789014 0.001834522 0.299914467 0.005072637 0 0 0.00161209 0.001298702 0.089699447 0.142593867 0.000376411 0.002330933 0 0.001327399 0.001097597 0.03860341 0 0 0 0 0 3.669075 0.000597372 0.013964757 0 0 0 0 0.09000634 0.008258084 0 0.007359527 0.007878707 0.000465538 0.00685913 0 0 0 0.127045867 0.1496607 0.005121529 0.083274037 0.00048337 0.171223333 0.000648847 0.001133725 0.001671958 0 0.04083076 0.002088291 7.955321667 0.088341057 0.05211077 0.311098233 0.055172103 0.001545542 0 0 0 0.007998207 0 0.005412257 0.00049712 0.000848168 0.06024569 0 0.003885457 7, 11-Dihydroxyferruginol 0 0 0 0.04695143 0.136297733 0 0.004474968 0 0 0 0 0 0.034973877 8.780003667 0.002112746 0 0.005151348 0 0 0.018839267 0 0 0.001699882 0.00074661 0.001130826 0.095859217 0 0.020159726 0 0 0 0 0.010253518 0.001362939 0 0 8.898685333 0.0040331 0.08255111 0.000587814 0 0 0.004287163 0 0.024098133 0.610447467 0 0 0 0.003355699 0 0 0.075983617 0.000331223 0.077632647 0.036181157 0 0.002623015 0.008889027 0 0 0 0.001085694 0.054548923 0 0.003167688 0 0 0 0 0.005709977 11, 14-Dihydroxysugiol 0 0.004752811 0.000469854 0.08165507 0.021529483 0 0.064715353 0.000395435 0 0.033178557 0.001492805 0.00470039 0.041463823 0.059724227 0.004693564 0.003410987 0.003638992 0.000951509 0.012830682 0.1601659 0.011777049 0 0.001086601 0.014644702 0 0.995982 0.01084321 0.020066 0 0 0 0.002161813 0.173323867 0.014819593 0.001656648 3.431352333 0.220615733 0.002969547 0.001588848 0.00295418 0.013371197 0.008111343 0.108466123 3.636680667 0.574228433 0.053188657 0.001149183 1.679136667 0.009453157 0.006744172 0.1734931 0.001109087 0.46719 0.000484654 0.08003717 0.263093767 0.030742517 0.085332693 3.279163 0.003985542 0.007161293 0.008027479 0.000551599 0.008291515 0.000489735 0.05907629 0.02414611 0.001186007 0.103391203 0.018232097 0.003356157 11-Hydroxyferruginol 0 0 0 0 0.112881447 0.001145821 0.002019479 0 0 0.002337633 0 0.000980876 0.00319939 0 0.009202749 0 0.000622966 0 0 0.107669793 0.001208511 0 0 0.00083719 0.001224713 0 0 0.026077696 0 0 0 0 0 0.01092786 0 0.170003737 0.040743867 0.002915881 0.002918483 0 0 0 0.000873299 0.192914833 0.057248937 0.08682194 0 0 0 0.000873205 0.01549005 0.004343791 0.023406687 0 0 0.060934657 0.004723541 0.024301077 0.04740681 0.000812239 0.001889255 0 0 0.0041346 0 0.006043071 0.001106942 0 0 0.001433174 0 20-Keto-2, 11-dihydroxyferruginol 0 0 0 0.09615085 0 0 0 0 0 0 0 0 0.051468573 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.10385154 0 0 0 0 0 0 0 0 0 0.03183825 0 0 0.07695557 0 0.263091933 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 20-Keto-11-hydroxysugiol 0 0 0 0 0 0.00421976 0 0 0 0 0 0 0.00319321 0 0 0 0.003769406 0 0 0.00915853 0 0 0 0 0 0 0 0.027863637 0 0 0.0004557 0 0 0 0 0 0.625877433 0 0 0 0 0.000726928 0.00277286 0 0 0 0 0 0 0 0 0 0.019850073 0 0 0.040032863 0 0 0 0.003339653 0 0 0 0 0 0.001241917 0 0 0 0 0 20-Keto-7-hydroxyferruginol 0 0 0 0.385514667 0.06485421 0 0.009060986 0 0 0.03949272 0 0.003679281 0.013798473 0.123853533 0 0.001216573 0 0 0 0.170409267 0.007992808 0 0 0.005810736 0 4.615916667 0 0.059850747 0 0 0 0 0.754731633 0.053932503 0.001197439 7.093578667 0.7285544 0.000440705 0 0 0 0 0.240615067 1.547417667 0.321444567 0.349403733 0 8.229904667 0 0 0.2162868 0 0.994334533 0 0.771145033 0.2031961 0.00660703 0.011832607 1.605181333 0 0 0.003051618 0 0.002205858 0 0.2852095 0.002859355 0.00086662 0.058908423 0.029327973 0 20-Keto-6-hydroxyferruginol 0 0 0 0.012863517 0 0 0 0 0 0 0 0 0.007418316 0.004335008 0 0 0 0 0 0.00585916 0 0 0 0 0 0.397108 0 0.001963643 0 0 0 0 0.032036353 0 0 0.151495033 0 0 0 0 0 0 0.028552673 0.344085767 0.053348423 0.006661037 0 0.082983883 0 0 0.021724457 0 0.051183923 0 0.102476997 0.005984737 0.001248727 0.004180506 0 0 0 0 0 0 0 0.005740212 0 0 0.003482099 0 0 20-Keto-7-acetyferruginol 0 0 0 0.459391967 0.000314349 0 0.014864917 0 0 0.018533203 0 0.00342062 0 0.132571067 0 0 0 0 0 0.427929233 0 0 0 0 0 4.056761667 0 0.2262175 0 0 0.000563144 0 1.516156 0.000414566 0 0.850348667 0.2428503 0 0 0 0 0 1.375802333 2.019881 0.212192 0 0 1.392196 0 0 0.1346823 0 1.351657333 0 0 0 0.001696251 0.001690609 0 0 0 0 0 0 0 0 0 0 0 0 0 7-Hydroxy-20-carboxyabietaquinone 0.3 0 0 0 0.305814723 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.343556295 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.302969669 0.258614581 0.263678173 0.422789345 0 0 0 0 0 0 0.044763959 0 0.921571652 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7-Hydroxyisocarnosol 1.5 0 0 0 0.78497835 0 0 0 0 0 0 0 0 0.000511546 0 0 0 0 0 0 0 0 0 0.773729523 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1.114014705 0.003366755 0.48094447 0.622518222 3.566237291 0 0 0 0 0 0 0.063208118 0 3.082331697 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6-Hydroxycarnosol 0.15 0 0 0 0.280679509 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.339429369 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.301658978 0 0.176776744 0.213761806 1.25914522 0 0 0 0 0 0 0 0 0.739939104 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7-Keto-carnosic acid 0 0 0 0 0.067664247 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.057933719 0 0 0.001296547 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.019494692 0.012756027 0.073567855 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7-Methoxycarnosol 0 0 0 0 0.064245804 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.040398442 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.303649475 0 0.06279189 0.097367475 0.579666466 0 0 0 0 0 0 0.015176412 0 0.863805979 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6-Methoxycarnosol 0 0 0 0 0.277433614 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.176368564 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.996440053 0 0.278790176 0.441285729 2.078268409 0 0 0 0 0 0 0.065190809 0 3.291071653 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Carnosol 0.4 0 0 0 3.42233777 0 0 0 0 0 0 0 0 0.00135821 0 0 0 0 0 0 0 0 0 2.823525429 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2.475579421 0.001684299 1.425902903 2.678153117 5.048676491 0 0 0 0 0 0 0.161981404 0 5.139779727 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Carnosic acid 0.016 0 0 0 2.852789005 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1.523425698 0 0 0 0 0 0 0 0 0 0 0 0.000588342 0 0 0.00016017 0 0 0.030059656 0 0.01997393 0.141936172 4.786601245 0 0 0 0 0 0 0.062924016 0 5.814021746 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Methyl carnosate 0 0 0 0 0.180079818 0 0 0 0 0 0 0 0 0.001787504 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.00202826 0 0 0 0 0 0 0 0 0.249930039 0.013091379 1.674043655 2.635421038 3.414957444 0 0 0 0 0 0 0 0 0.816369414 0 0 0 0 0 0 0 0.002785167 0 0 0 0 0 0 0 0 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Retention time m/z Adduct type Molecular formula PPM 7, 20-Dihydroxyabietaquinone 17.1 331.1903 [M-H]- C20H28O4 -1.5 16, 20-Dihydroxyabietaquinone 19.09 331.19 [M-H]- C20H28O4 -2.4 7-Keto, 20-hydroxyabietaquinone 19.88 329.175 [M-H]- C20H26O4 -1.2 11, 20-Dihydroxysugiol 20.45 331.19 [M-H]- C20H28O4 0 20-Hydroxyabietaquinone 21.7 315.1953 [M-H]- C20H28O3 -0.3 Miltirone 25.89 283.1698 [M+H]+ C19H22O2 0 Cryptotanshinone 21.84 297.1494 [M+H]+ C19H20O3 1.7 Tanshinone IIA 24.84 295.1337 [M+H]+ C19H18O3 0 1, 2-Dihydrotanshinquinone 22.88 279.1026 [M+H]+ C18H12O2 0 Dihydrotanshinone I 19.88 279.1025 [M+H]+ C18H14O3 0.4 Methylenetanshinquinone 20.38 281.1184 [M+H]+ C18H16O3 1.4 Tanshinone I 21.31 277.0867 [M+H]+ C18H12O3 -1.8 Przewaquinone C 17.13 297.1127 [M+H]+ C18H18O4 -0.7 7-Keto-royleanone 20.78 329.175 [M-H]- C20H26O4 -0.9 Royleanone 21.13 315.1957 [M-H]- C20H28O3 -0.3 11-Hydroxysugiol 21.54 315.1954 [M-H]- C20H28O3 -2.2 7-Hydroxyroyleanone 21.72 331.1906 [M-H]- C20H28O3 -0.3 6-Hydroxyroyleanone 22.07 331.1898 [M-H]- C20H28O4 -2.7 6-Keto-11-hydroxysugiol 22.9 329.1752 [M-H]- C20H26O4 -1.2 7, 11-Dihydroxyferruginol 24.5 317.2108 [M-H]- C20H30O3 -1.6 11, 14-Dihydroxysugiol 24.48 331.19 [M-H]- C20H28O4 -1.8 11-Hydroxyferruginol 29.09 301.2162 [M-H]- C20H30O2 -2.7 20-Keto-2, 11-dihydroxyferruginol 19.5 331.1897 [M-H]- C20H28O4 -2.1 20-Keto-11-hydroxysugiol 19.98 329.1749 [M-H]- C20H26O4 -1.2 20-Keto-7-hydroxyferruginol 23.84 331.1904 [M-H]- C20H28O4 -3.9 20-Keto-6-hydroxyferruginol 24.89 331.1902 [M-H]- C20H28O4 -2.1 20-Keto-7-acetyferruginol 27.17 373.2004 [M-H]- C22H30O5 -2.9 7-Hydroxy-20-carboxyabietaquinone 16.6 345.1692 [M-H]- C20H26O5 -2.3 7-Hydroxyisocarnosol 17.14 345.1696 [M-H]- C20H26O5 -3.5 6-Hydroxycarnosol 17.77 345.1691 [M-H]- C20H26O5 -2.6 7-Keto-carnosic acid 18.64 345.1689 [M-H]- C20H26O5 -3.8 7-Methoxycarnosol 20.05 359.187 [M-H]- C21H28O5 -3.3 6-Methoxycarnosol 20.41 359.1854 [M-H]- C21H28O5 -3.3 Carnosol 20.6 329.1758 [M-H]- C20H26O4 -1.8 Carnosic acid 22.8 331.1904 [M-H]- C20H28O4 -1.5 Methyl carnosate 24.61 345.2057 [M-H]- C21H30O4 -4.6 METABOLITES_END #END