Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST001955)

(Analysis AN003180)

Metabolite	Structure	F1	F2
3-Caffeoylquinic acid	ME451062	0.12	1.88
(2^E,4^Z,7^Z,8E)-Colnelenic acid	ME451019	0.15	1.85
3^,4^,5,7-Tetrahydroxy-3,6,8-trimethoxyflavone	ME451056	0.16	1.84
Cryptochlorogenic acid	ME451129	0.24	1.76
3,4-Methylenesebacic acid	ME451057	0.33	1.67
Dodecanedioic acid	ME451143	0.28	1.72
Methylsuccinic acid	ME451210	0.31	1.69
4,5-Dihydrovomifoliol	ME451080	0.30	1.70
Fluorescein	ME451150	0.30	1.70
3-tert-Butyl-2-hydroxybenzaldehyde	ME451077	0.48	1.52
Traumatic acid	ME451257	0.49	1.51
Succinic acid	ME451248	0.49	1.51
2,6-Dihydroxybenzoic acid	ME451046	0.49	1.51
Leu-Arg	ME451184	0.49	1.51
Phenol	ME451229	0.52	1.48
Maysin	ME451203	0.56	1.44
4-Hydroxybenzoic acid	ME451084	0.55	1.45
Jasmonic acid	ME451179	0.54	1.46
Phenylethyl primeveroside	ME451230	0.54	1.46
Crispanone	ME451128	0.58	1.42
Robinin	ME451238	0.59	1.41
9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid	ME451101	0.63	1.37
Guanosine	ME451166	0.62	1.38
Butyl 3-hydroxy-2-methylidenebutanoate	ME451120	0.60	1.40
Gentian Violet	ME451153	0.61	1.39
LysoPE 16:0	ME451200	0.72	1.28
Citric acid	ME451125	0.75	1.25
Leu-Ala	ME451183	0.74	1.26
Phytocassane B	ME451233	0.74	1.26
10-Nitrolinoleic acid	ME451028	0.70	1.30
Kaempferol 3-O-sophoroside	ME451180	0.70	1.30
Prexanthoperol	ME451236	0.69	1.31
Ethyl p-coumarate	ME451147	0.68	1.32
15,16-DiHODE	ME451037	0.68	1.32
2-(2-Thienyl)furan	ME451044	0.68	1.32
2-Hydroxy-4-oxopentanoic acid	ME451051	0.64	1.36
Methacrolein	ME451207	0.65	1.35
3-Hydroxyphenyl-valeric acid	ME451072	0.67	1.33
Norisoboldine	ME451218	0.66	1.34
2-Isopropylmalic acid	ME451053	0.66	1.34
Naringenin	ME451214	0.66	1.34
Sucrose	ME451249	1.14	0.86
DGDG 36:6; DGDG(18:3/18:3)	ME451138	1.14	0.86
1,11-Undecanedicarboxylic acid	ME451027	1.14	0.86
3-Azetidinecarboxylic acid, 1-(4-fluorobenzoyl)-3-[[(6-methoxy-2-naphthalenyl)oxy]methyl]-	ME451061	1.14	0.86
Allose	ME451110	1.15	0.85
5.alpha.-Pregnan-3.alpha.,17-diol-20-one 3-sulfate	ME451092	1.15	0.85
3,5-Di-tert-butyl-2-hydroxybenzaldehyde	ME451058	1.15	0.85
5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-4H-chromen-4-one	ME451090	1.15	0.85
D-Malic acid	ME451142	1.18	0.82
9-Hydroxybenzo[a]pyrene-4,5-oxide	ME451100	1.18	0.82
Diacetyl	ME451140	1.18	0.82
PA 34:3; PA(16:0/18:3)	ME451223	1.16	0.84
Mesaconic acid	ME451206	1.16	0.84
1b-Hydroxycholic acid	ME451042	1.16	0.84
(9R,10S,12Z)-9,10-Dihydroxy-8-oxo-12-octadecenoic acid	ME451025	1.16	0.84
Dapsone	ME451134	1.17	0.83
9^-Carboxy-gamma-tocotrienol	ME451097	1.17	0.83
Bavachinin	ME451119	1.17	0.83
Val-Asp	ME451262	1.09	0.91
Glu-Leu	ME451159	1.09	0.91
Azelaic acid	ME451118	1.09	0.91
Dehydroascorbic acid	ME451135	1.09	0.91
Val-Val-Val	ME451266	1.08	0.92
Ser-Leu	ME451241	1.08	0.92
Goshuyic acid	ME451164	1.08	0.92
.beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]-	ME451026	1.08	0.92
Cytidine	ME451131	1.08	0.92
PC 36:2; PC(18:0/18:2)	ME451225	1.12	0.88
6-Hydroxynicotinic acid	ME451094	1.12	0.88
4-N-(N-Acetyl-D-glucosaminyl)-protein	ME451085	1.12	0.88
4-O-.beta.-Galactopyranosyl-D-mannopyranose	ME451086	1.12	0.88
(-)-Quinic acid	ME451016	1.13	0.87
Corchorifatty acid D	ME451126	1.13	0.87
Flavin Mononucleotide	ME451149	1.13	0.87
4-Pyridoxic acid	ME451087	1.10	0.90
Ala-Trp	ME451109	1.10	0.90
5-(3^,5^)-Dihydroxyphenyl-gamma-valerolactone	ME451088	1.11	0.89
Tyrosyl-Threonine	ME451260	1.11	0.89
Acetic anhydride	ME451105	1.38	0.62
trans-Traumatic acid	ME451256	1.35	0.65
Alpha-Linolenic acid	ME451111	1.36	0.64
Demethylcalabaxanthone	ME451137	1.36	0.64
Ala-Ile	ME451107	1.30	0.70
Methyl 3-hydroxybenzoate	ME451209	1.32	0.68
2-Benzoxazolol	ME451047	1.32	0.68
Ecabet	ME451144	1.32	0.68
Garcinia acid	ME451152	1.31	0.69
Vitexin 4-O-glucoside	ME451275	1.31	0.69
3-Hydroxydodecanedioic acid	ME451070	1.34	0.66
Traumatin	ME451258	1.33	0.67
Pyroglutamic acid	ME451237	1.33	0.67
N-Methylaspidospermatidine	ME451216	1.33	0.67
LysoPC 16:0	ME451198	1.33	0.67
3-Hydroxybenzaldehyde	ME451068	1.33	0.67
Gibberellin A99	ME451155	1.33	0.67
Hydroxygaleon	ME451169	1.20	0.80
L-Gulono-1,4-lactone	ME451188	1.20	0.80
3-Methylbenzaldehyde	ME451074	1.22	0.78
Valyl-Alanine	ME451267	1.21	0.79
Aspartate	ME451117	1.21	0.79
Apigenin 6-C-glucoside 8-C-arabinoside	ME451114	1.21	0.79
Adenine	ME451106	1.21	0.79
Ala-Phe	ME451108	1.21	0.79
3-Oxohexadecanoic acid	ME451076	1.28	0.72
Seselin	ME451243	1.28	0.72
Asn-Leu	ME451115	1.27	0.73
Cinobufagin	ME451123	1.27	0.73
3-Coumaric acid	ME451063	1.26	0.74
Pentadecanoic acid	ME451228	1.25	0.75
Linoleic acid	ME451191	1.25	0.75
Anethofuran	ME451112	1.25	0.75
D-2,3-Dihydroxypropanoic acid	ME451133	1.25	0.75
3-Cyclopentene-1-octanoic acid, 2-(3-hydroxy-1-penten-1-yl)-5-oxo-	ME451064	1.24	0.76
trans-Aconitic acid	ME451255	1.23	0.77
Sebacic acid	ME451240	1.23	0.77
D-Gluconic acid	ME451139	1.23	0.77
Diosmin	ME451141	1.23	0.77
2^-Hydroxy-2,3,5^-trimethoxychalcone	ME451050	0.86	1.14
(6beta,7alpha,12beta,13beta)-7-Hydroxy-11,16-dioxo-8,14-apianadien-22,6-olide	ME451024	0.83	1.17
2,5-Dimethylfuran	ME451045	0.85	1.15
9-Hydroperoxy-10E,12Z,15Z-octadecatrienoic acid	ME451099	0.85	1.15
Stearic acid	ME451246	0.84	1.16
Pheophorbide a	ME451231	0.84	1.16
L-Norleucine	ME451192	0.84	1.16
(2xi,20beta)-2,20-Dihydroxy-3-oxo-12-ursen-28-oic acid	ME451020	0.84	1.16
Hexadecanedioic acid	ME451168	0.84	1.16
2-Ethyl-2-hexenal	ME451048	0.78	1.22
2-Naphthalenethiol	ME451055	0.77	1.23
Malonic acid	ME451202	0.77	1.23
17-Hydroxylinolenic acid	ME451040	0.82	1.18
Simvastatin	ME451245	0.81	1.19
LysoPC 18:2	ME451199	0.81	1.19
2-Furancarboxylic acid	ME451049	0.81	1.19
Gibberellin A22	ME451154	0.81	1.19
3-Hydroxybenzoic acid	ME451069	0.80	1.20
8-Hydroxyquinoline-5-carboxylic acid	ME451095	0.79	1.21
Orientin	ME451221	0.79	1.21
Isoleucyl-Tyrosine	ME451177	0.94	1.06
Isoleucyl-Leucine	ME451175	0.94	1.06
(-)-Hydroxycitric acid lactone	ME451015	0.94	1.06
3-O-p-Coumaroylquinic acid	ME451075	0.94	1.06
12-Oxo-2,3-dinor-10,15-phytodienoic acid	ME451032	0.94	1.06
3-Methyl-1-penten-3-ol	ME451073	0.94	1.06
Vitamin C	ME451273	0.93	1.07
Val-Pro	ME451264	0.93	1.07
Naphthalene	ME451213	0.93	1.07
Momilactone A	ME451212	0.93	1.07
Linarin	ME451190	0.93	1.07
Delphinidin-3-O-(6^^-O-alpha-rhamnopyranosyl-beta-glucopyranoside)	ME451136	0.93	1.07
Erlose	ME451146	0.93	1.07
Vitexin	ME451274	0.95	1.05
Val-Tyr	ME451265	0.95	1.05
Tryptophan	ME451259	0.95	1.05
N-Nitroso-N-methyl-3-aminopropionic acid	ME451217	0.95	1.05
Glabrone	ME451156	0.95	1.05
Echinocystic acid-3-O-glucoside	ME451145	0.95	1.05
(3.beta.)-Allopregnanolone sulfate	ME451021	0.95	1.05
C.I. Pigment Red 149	ME451121	0.95	1.05
Palmitic acid	ME451224	0.96	1.04
N-lactoyl-Isoeucine	ME451215	0.96	1.04
Leu-Pro	ME451186	0.96	1.04
Asn-Phe	ME451116	0.96	1.04
Kaempferol-7-O-neohesperidoside	ME451181	0.96	1.04
Sugiol	ME451250	0.89	1.11
Ser-Phe	ME451242	0.89	1.11
Oleic acid	ME451220	0.89	1.11
Gly-Phe	ME451163	0.89	1.11
3,7-Dihydroxy-12-oxocholanoic acid	ME451059	0.89	1.11
5-O-Caffeoylquinic acid methyl ester	ME451093	0.89	1.11
Isochlorogenic acid b	ME451173	0.87	1.13
L-Threonine	ME451195	0.88	1.12
L-Glutamine	ME451187	0.88	1.12
13,14-Dihydro-16,16-difluoroprostaglandin D2	ME451033	0.88	1.12
3-Hydroxy-3-methylglutaric acid	ME451066	0.88	1.12
Trandolaprilat	ME451254	0.92	1.08
Pelargonic acid	ME451227	0.92	1.08
PE(18:1(9Z)/18:1(9Z))	ME451226	0.92	1.08
Acetaminophen sulfate	ME451103	0.92	1.08
Isoferulic acid	ME451174	0.92	1.08
Sapidolide A	ME451239	0.90	1.10
(10E,12Z)-9-HODE	ME451018	0.90	1.10
Maleic acid	ME451201	0.90	1.10
PI 34:3; PI(16:1/18:2)	ME451234	0.91	1.09
Gln-Ile	ME451158	0.91	1.09
4,8,12,15-Octadecatetraenoic acid	ME451081	0.91	1.09
1b,3a,12a-Trihydroxy-5b-cholanoic acid	ME451041	0.91	1.09
11-Ketoetiocholanolone	ME451029	0.91	1.09
12(13)Ep-9-KODE	ME451030	0.91	1.09
Thr-Phe	ME451253	1.04	0.96
Thr-Leu	ME451252	1.04	0.96
Melanin	ME451204	1.04	0.96
Antibiotic GR 95647X	ME451113	1.04	0.96
4,4^-Methylenedianiline	ME451078	1.04	0.96
16-Hydroxyhexadecanoic acid	ME451039	1.04	0.96
3-Hydroxyoctanoic acid	ME451071	1.04	0.96
Valyl-Phenylalanine	ME451269	1.03	0.97
Guanine	ME451165	1.03	0.97
Glyceraldehyde	ME451161	1.03	0.97
3-Hydroxy-4-methoxycinnamic acid	ME451067	1.03	0.97
4-Acetyl-2-methylpyridine	ME451082	1.03	0.97
N-Undecanoylglycine	ME451219	1.05	0.95
L-Tyrosine	ME451196	1.05	0.95
MGDG 11:0; MGDG(5:0/6:0)	ME451211	1.05	0.95
Picolinic acid	ME451235	1.06	0.94
Ile-Thr	ME451172	1.06	0.94
Guanosine-3^,5^-cyclic monophosphate	ME451167	1.06	0.94
Acetic acid	ME451104	1.06	0.94
Acetaldehyde	ME451102	1.06	0.94
2-Keto-3-deoxyoctonic acid	ME451054	1.06	0.94
12,13-Dihydroxy-9Z-octadecenoic acid	ME451031	1.06	0.94
13-OxoODE	ME451036	1.06	0.94
(3beta,8beta)-3-Hydroxy-7(11)-eremophilen-12,8-olide	ME451022	1.07	0.93
Chlorotrianisene	ME451122	1.07	0.93
Methoxyeugenol	ME451208	1.02	0.98
L-Phenylalanine	ME451193	1.02	0.98
9,10,13-TriHOME	ME451096	1.02	0.98
Cynarin	ME451130	1.02	0.98
Vitexin-2^^-O-rhamnoside	ME451276	1.01	0.99
LysoPA 16:0; LysoPA 16:0	ME451197	1.01	0.99
Ile-Gly-Ile	ME451170	1.01	0.99
D-(+)-Pantothenic acid	ME451132	1.01	0.99
(3-Methyl-2-butenyl)-benzene	ME451023	1.01	0.99
2-hydroxystearate	ME451052	1.01	0.99
(10betaH,11xi)-11-Hydroxy-13-nor-6-eremophilen-8-one	ME451017	1.01	0.99
15-Hydroxy-11Z,13E-eicosadienoic acid	ME451038	1.01	0.99
Oxoglutaric acid	ME451222	1.00	1.00
Isoleucyl-Tryptophan	ME451176	1.00	1.00
Ile-Phe	ME451171	1.00	1.00
Corchorifatty acid F	ME451127	1.00	1.00
4-Aminophenol	ME451083	1.00	1.00
1-Methyl-6-phenyl-1H-imidazo[4,5-b]pyridin-2-amine	ME451043	1.00	1.00
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid	ME451065	1.00	1.00
Glycyl-L-norleucine	ME451162	0.99	1.01
Fragransol C	ME451151	0.99	1.01
5,3^-Dihydroxy-6,7,4^-trimethoxyflavone	ME451089	0.99	1.01
Eucalyptol	ME451148	0.99	1.01
Valyl-Valine	ME451271	0.97	1.03
Valyl-Tryptophan	ME451270	0.97	1.03
Valyl-Methionine	ME451268	0.97	1.03
Val-Leu	ME451263	0.97	1.03
Suberic acid	ME451247	0.97	1.03
Leu-Glu	ME451185	0.97	1.03
4^,5,7-Trihydroxy 3,3^,6,8-tetramethoxyflavone	ME451079	0.97	1.03
5,7-Dihydroxy-3^,4^,5^-trimethoxyflavone	ME451091	0.97	1.03
Uridine	ME451261	0.98	1.02
Phe-Pro	ME451232	0.98	1.02
L-Histidine	ME451189	0.98	1.02
Melezitose	ME451205	0.98	1.02
Citraconic acid	ME451124	1.78	0.22
Shikimic acid	ME451244	1.47	0.53
9-HOTE	ME451098	1.46	0.54
L-Serine	ME451194	1.46	0.54
13-HODE	ME451034	1.43	0.57
Kessyl glycol	ME451182	1.43	0.57
13-Oxo-9,11-tridecadienoic acid	ME451035	1.40	0.60
Vanillic acid	ME451272	1.41	0.59
Isorhamnetin-3-O-rutinoside	ME451178	1.55	0.45
GlcADG 34:2; GlcADG(16:0/18:2)	ME451157	1.55	0.45
Glutamylvaline	ME451160	1.55	0.45
3a,7a,12a-Trihydroxy-5b-cholestan-26-al	ME451060	1.69	0.31
Tangeraxanthin	ME451251	1.62	0.38

Factors:

F1	Treatment:control
F2	Treatment:Moisture treatment

Data matrix