Metabolomics Workbench : NIH Data Repository : Analyze Studies

Data for ST000242

(Analysis AN000377): Average values per metabolite and experimental factor (Units:Peak area)

Metabolite structure	F1	F2	F3
11-amino-undecanoic acid	12.66	13.22	-
14-Deacetylnudicauline	22.08	19.94	21.94
1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate)-beta-D-Glu...	14.20	13.36	-
1^H-5alpha-Cholest-2-eno[3,2-b]indole	-	-	13.59
20,21,21-Trifluoro-3-methoxy-19-nor-17alpha-pregna-1,3,5(10)...	11.88	11.86	-
3-(7^-Methylthio)heptylmalic acid	13.02	13.84	14.53
3-Buten-1-amine	13.51	14.41	13.73
3-Indolebutyric acid	11.29	11.39	11.61
4-Methylene-L-glutamine	16.90	-	-
5-Acetylamino-6-formylamino-3-methyluracil	14.05	14.69	14.80
5-Amino-1-ribofuranosylimidazole-4-carboxyamide	14.91	15.95	17.64
5-Aminopentanoic acid	18.02	18.00	19.05
5?-Deoxy-5?-(methylthio)adenosine	15.93	15.66	-
5-Nitro-ortho-anisidine	17.95	19.72	20.22
5-O-(Indol-3-ylacetyl-myo-inositol) D-galactoside	13.22	13.98	14.41
5-O-Methylembelin	-	12.89	-
5-O-Methylvisamminol	11.79	13.46	-
6-Imino-5-oxocyclohexa-1,3-dienecarboxylate	17.36	19.82	20.24
acetohydroxamic acid	16.26	16.80	-
Adenine	20.10	20.89	21.68
ADMA	14.59	15.72	-
alpha,beta-Dihydroxyethyl-TPP	11.77	12.37	13.94
Amoxicillin	13.55	13.72	13.34
Amphibine B	-	12.30	-
Aridanin	-	-	11.73
Azatadine	-	12.74	12.48
Bispyribac	14.16	13.46	-
Boschniakine	13.37	13.37	-
Butyric acid	13.87	14.27	14.19
Bz-Arg-OEt	12.68	13.59	13.56
?-Caprolactam	13.11	12.85	-
Caylin-2	12.26	11.75	12.32
cefoperazone	11.63	11.91	12.13
CerP(d18:1/18:0)	-	-	13.46
CerP(d18:1/20:0)	-	-	14.24
Chivosazole F	15.28	15.11	16.41
Chlorophyll a	17.26	17.19	16.89
Chlorophyllide b	-	-	11.45
Citiolone	13.64	14.97	-
Clindamycin phosphate	15.51	15.43	16.18
Colnelenic acid	-	-	13.71
Compound III(S)	19.32	19.71	19.43
Coumarin	12.48	12.34	12.69
Creatine	16.07	17.62	-
Creatinine	13.62	14.59	-
Cyclopiazonic Acid	13.70	13.70	-
Cys Cys Ile	14.71	13.68	-
Cytarabine	16.08	15.56	-
Cytosine	14.06	15.58	-
Daunorubicin	12.54	12.33	-
Dehydrofalcarinone	16.57	18.47	17.38
Deoxyadenosine	12.86	-	-
Deoxycytidine	15.13	14.81	-
DG(17:2(9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2]	13.98	15.01	13.69
D-Glucosyldihydrosphingosine	12.45	12.80	12.34
Dicyclohexyl phthalate	-	11.75	-
Digitoxigenin bisdigitoxoside	16.65	17.11	16.17
Diglycolic acid	12.55	12.17	12.50
Digoxigenin bisdigitoxoside	12.87	14.00	14.29
dIMP	12.25	12.97	13.21
Dinor-PGD2	13.42	13.01	-
Disulfiram	15.95	16.10	-
D-Proline	14.44	12.17	14.11
E3040 glucuronide	11.91	12.78	12.93
Elloramycin A	16.13	16.00	-
Enterochelin	15.63	15.04	-
Ergine	15.88	15.55	-
Erythromycin B	15.72	16.11	15.34
Erythrono-1,4-lactone	13.92	14.32	15.06
Ethanolamine	15.85	16.24	-
Fenbuconazole	14.05	14.00	-
Ferroxamine	11.88	11.48	11.56
Firocoxib	15.67	16.15	16.55
FKGK 11	12.84	13.01	-
Fortimicin A	13.47	14.05	13.39
Fraxin	17.72	16.69	17.61
Gal?1-3Gal?1-4GlcNAc?-Sp	12.70	12.02	12.70
Glafenine	13.14	12.61	11.50
Gln Asn Glu	14.95	15.77	16.07
Gln Glu Lys	-	14.23	-
Glucocerebrosides	12.39	12.90	12.00
Glucosylceramide (d18:1/18:0)	13.25	13.63	13.15
Glu Met Trp	14.75	13.91	13.12
Gly Lys Phe	12.72	13.84	13.67
Guanidinosuccinic Acid	15.94	16.77	17.43
Guanine	-	15.06	17.52
Gymnemic acid I	13.15	13.58	12.69
gypsogenin 3-O-rhamnosylglucosiduronic acid	12.05	11.60	11.92
Haplanthin	12.59	12.32	12.51
Harpagoside	20.22	16.72	20.05
Helilandin B	14.53	16.63	16.95
Hexazinone	13.60	14.31	15.04
His-Thr-OH	12.13	12.89	13.16
Homoserine lactone	14.53	15.66	16.38
Hydroxytetrabenazine glucuronide	13.01	12.42	11.92
(-)-Hygroline	16.00	17.02	-
Hypoxanthine	17.06	17.33	18.12
ICI 164384	-	-	13.49
Ingenol 3,20-dibenzoate	12.60	13.71	14.77
Ins-1-P-Cer(t18:0/26:0)	-	-	12.71
Isoalangiside	11.94	12.12	-
Isobutyronitrile	12.85	13.99	14.53
Isoprene	19.52	20.28	20.65
Istamycin C	12.70	13.92	13.68
Istamycin C1	18.79	19.23	18.79
IU1	-	11.55	-
Jadomycin B	12.15	15.09	13.68
JWH 018 4-hydroxyindole metabolite	16.10	13.75	-
Khellin	13.49	13.51	-
Kinetin Riboside	13.17	13.62	14.88
Labriformidin	13.18	12.43	13.51
LacCer(d18:0/26:0)	-	-	11.51
Lankacidin C	14.22	15.01	15.39
Leoidin Dimethyl Ether	11.67	13.52	13.65
Leu Cys Phe	14.01	13.77	-
Linoleoyl Ethanolamide	11.48	12.08	-
L-Isoleucine	19.24	19.81	20.18
Lithocholic acid taurine conjugate	11.39	12.08	12.19
L-Leucine	18.63	19.40	19.80
Lucidine B	-	-	12.93
Luteolin 7,3^-digalacturonide	-	-	12.18
Lys Cys Asn	15.44	14.64	15.73
Lys Ser Lys	12.74	12.62	12.34
Lys Tyr Ile	11.88	-	12.10
Lys Val Lys	-	12.96	13.07
Malyngamide J	17.55	18.02	17.23
Medermycin	12.00	12.71	12.86
Met Arg	-	17.38	14.88
Methoprene (S)	-	12.34	15.43
methyl 10,12,13,15-bisepidioxy-16-hydroperoxy-8E-octadecenoa...	11.44	13.05	-
?-Methyltryptamine (AMT)	14.77	15.06	15.29
Met-Trp-OH	14.98	15.08	-
MG(0:0/22:0/0:0)	12.32	12.52	-
MID42085:(6RS)-6,19-epidioxy-24,24-difluoro-25-hydroxy-6,19-...	11.63	11.38	11.71
MID42333:24,24-difluoro-1?,25-dihydroxy-26,27-dimethylvitami...	-	-	12.46
MID42395:26,27-diethyl-1?,25-dihydroxy-22-thiavitamin D3 / 2...	11.42	11.69	-
MID42466:11?-(4-dimethylaminophenyl)-1?,25-dihydroxyvitamin ...	-	-	13.57
Myricetin 3-glucuronide	14.17	13.48	14.02
N-(2-hydroxyethyl)henicosanamide	-	-	12.35
N-(3-pyridyl)-Indomethacin amide	16.79	17.21	17.52
N4-Acetylsulfadoxine	14.31	14.40	-
N-acyl capnines	-	-	13.12
Naloxone-3-glucuronide	12.72	11.95	12.96
Nap-Trp-OH	12.88	13.33	-
Neobanone	17.94	16.59	16.37
Neopinone	13.77	13.72	-
Netilmicin	18.33	18.81	18.26
Neu5Ac?2-6GalNAc?-Thr	12.17	12.74	-
N-Formylmethionylphenylalanine	12.45	13.61	-
Niacinamide	14.09	13.66	13.21
Nitrothal-isopropyl	16.91	16.52	-
Nizatidine	-	-	14.52
N-methylundec-10-enamide	13.90	13.73	13.42
N,N-Dimethyltryptamine (DMT)	15.05	15.13	14.70
n-Pentadecylamine	14.18	-	-
NS 1619	12.26	12.74	12.75
Oleoyl-EA(d2)	-	-	12.73
Orizabin	15.85	15.65	-
Orlistat	11.45	12.13	11.52
Ornaline	13.70	14.12	-
Ouabain	13.21	13.65	-
Oxolucidine B	-	13.34	12.74
Oxotolrestat glucuronide	12.12	12.59	13.11
Paraldehyde	14.47	14.78	14.88
Parillin	-	11.56	-
Patuletin 3-(6^^-(E)-feruloylglucoside)	13.13	13.91	-
PE(14:0/22:2(13Z,16Z))	15.39	14.51	15.48
PE(17:1(9Z)/18:0)	-	-	13.16
PE(17:2(9Z,12Z)/20:0)	-	-	13.67
Pencycuron	13.94	14.81	15.14
Penicillin G	16.39	17.52	-
Penicilloic G acid	16.72	16.43	-
PE-NMe(18:0/18:0)[U]	-	-	14.91
PE(O-16:0/17:0)	-	-	13.32
PE(P-16:0/19:0)	-	-	15.02
PE(P-18:1(11Z)/15:0)	-	-	13.25
Peucenin	13.21	14.00	13.34
PG(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)	15.87	16.04	16.40
Phaseolotoxin	12.63	13.32	13.78
Phe4Cl-His-OH	11.39	11.84	12.91
Phenylacetylglycine	17.24	16.85	-
Phenylbutyrylglutamine	15.96	16.24	16.85
Phenylpyruvic acid	16.43	17.20	17.54
Phosphatidyl glycerol	14.85	13.70	14.85
Phosphinothricin	-	12.64	13.06
p-Hydroxypropoxyphene	12.46	13.02	12.88
PI(19:1(9Z)/0:0)	12.81	13.42	12.55
PI(20:4(5Z,8Z,11Z,14Z)/0:0)	12.51	13.45	12.04
Piperidine	19.79	20.35	20.72
Pirimicarb	19.71	20.07	20.07
Pratensin A	-	13.29	12.78
Prorepensin	12.98	13.47	14.20
Prothioconazole	13.28	13.51	14.86
PS(12:0/14:0)	17.12	17.58	16.65
PS(15:1(9Z)/14:1(9Z))	11.54	11.94	11.60
PS(18:1(9Z)/16:1(9Z))	-	-	14.47
PS(18:3(6Z,9Z,12Z)/19:1(9Z))	13.33	13.32	13.66
PS(20:0/20:1(11Z))	-	-	14.34
PS(20:1(11Z)/0:0)	13.07	12.76	12.57
PS(22:0/20:2(11Z,14Z))	-	-	14.11
PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/19:0)	11.73	12.10	11.32
Pseudopelletierine	13.94	13.94	12.55
PS(O-16:0/12:0)	-	-	13.00
PS(O-16:0/13:0)	-	-	11.97
PS(O-16:0/20:1(11Z))	-	-	12.66
PS(O-16:0/22:0)	-	-	14.55
PS(O-18:0/12:0)	-	-	14.57
PS(P-16:0/22:1(11Z))	-	-	13.52
PS(P-20:0/17:1(9Z))	15.20	13.86	15.01
Pyrroline hydroxycarboxylic acid	18.11	20.22	20.94
Pyrromycin	-	-	11.73
Quercetin 3-(6^^-malonylglucoside)-7-glucoside	14.76	15.37	-
Queuine	-	-	13.58
Rescinnamine	13.32	13.29	13.84
Rifamycin S	12.02	13.19	14.33
Sannamycin A	13.06	13.80	13.64
Sarcosine	15.07	15.50	-
Sativic acid	-	-	12.82
Septentriodine	15.52	14.46	14.95
Serotonin	13.16	13.62	-
sn-glycero-3-Phosphoethanolamine	14.04	14.02	-
Spectinomycin adenylate	18.13	17.13	18.42
Spheroidene	12.87	13.18	-
Sphingofungin D	13.43	13.45	-
Streptidine	16.07	16.34	-
Streptomycin	13.94	14.30	13.39
Sulfamerazine	13.34	13.42	13.68
Symlandine	12.05	11.97	-
THTC	16.28	17.05	17.32
Tributyl phosphate	13.79	13.58	13.40
Tricetin 3^-methyl ether 7,5^-diglucuronide	-	-	12.15
Trichotomine	-	11.89	-
Trimethylamine	13.17	14.52	14.12
Trp-Lys-OH	16.07	14.59	-
Tyr Asp His	-	12.16	13.05
Tyr Glu Glu	14.28	15.35	16.18
Tyrphostin B44 (-)	19.77	20.56	-
Tyr Thr Lys	14.88	14.82	14.16
Tyr Val Phe	11.66	11.50	11.56
UDP-N-acetylmuraminate	-	-	12.36
Uscharidin	12.19	11.61	12.02
V-PYRRO/NO	16.36	17.27	15.50
Yamogenin 3-O-neohesperidoside	13.23	13.68	12.86

Factors:

F1	Sample Status:Whole M1 medium
F2	Sample Status:Whole M2 medium
F3	Sample Status: Whole unconditioned medium (Defined culture media, M199)