Exact Mass: 316.1674504

A C19-gibberellin that is a pentacyclic diterpenoid responsible for promoting growth and elongation of cells in plants. Initially identified in Gibberella fujikuroi it differs from gibberellin A1 in the absence of OH groups at C-2 and C-7 (gibbane numberings).

3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione

Bisphenol A bis(2-hydroxyethyl)ether

2-(4-{2-[4-(2-hydroxyethoxy)phenyl]propan-2-yl}phenoxy)ethan-1-ol

1-Dehydro-15alpha-hydroxytestololactone

4-hydroxy-10a,12a-dimethyl-3,4,4a,5,6,10a,10b,11,12,12a-decahydro-2h-naphtho[2,1-f]chromene-2,8(4bh)-dione

11beta,13-Dihydroxy-3-oxo-13,17-secoandrosta-1,4-dien-17-oic acid, delta-lactone

Capillartemisin A

Imipramine hydrochloride

C19H25ClN2 (316.170616)

D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018759 - Adrenergic Uptake Inhibitors C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent > C94727 - Tricyclic Antidepressant D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents D049990 - Membrane Transport Modulators

Capillartemisin B

(E)-3-[4-hydroxy-3-[(Z)-4-hydroxy-3-methyl-but-2-enyl]-5-(3-methylbut- 2-enyl)phenyl]prop-2-enoic acid

Isopulegone caffeate

[4-(Prop-1-en-2-yl)cyclohexyl]methyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid

Isopulegone caffeate is found in fats and oils. Isopulegone caffeate is a constituent of Perilla frutescens var. crispa

estradiol alone

5,14-dihydroxy-15-methyl-4-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2(7),5-diene-3-carbaldehyde

Fluorocarazolol

1-(9H-Carbazol-4-yloxy)-3-((1-(fluoromethyl)ethyl)amino)-2-propanol

Navoximod

4-(2-{6-fluoro-5H-imidazo[4,3-a]isoindol-5-yl}-1-hydroxyethyl)cyclohexan-1-ol

Porphyrinogen

21,22,23,24-tetraazapentacyclo[16.2.1.1^{3,6}.1^{8,11}.1^{13,16}]tetracosa-1(20),3,5,8,10,13,15,18-octaene

C20H20N4 (316.168788)

Gibberellin A9

11-Methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid

Gibberellin a9 is a member of the class of compounds known as c19-gibberellin 6-carboxylic acids. C19-gibberellin 6-carboxylic acids are c19-gibberellins with a carboxyl group at the 6-position. Gibberellin a9 is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a9 can be found in a number of food items such as black mulberry, saffron, pear, and winter squash, which makes gibberellin a9 a potential biomarker for the consumption of these food products.

adenostylone

Zaluzanin C isobutyrate

(+)-Zaluzanin C isobutyrate

Chaetopyranin

A chromenol that is 3,4-dihydro-2H-chromene substituted by a hydroxy group at position 6, a 3-hydroxybut-1-en-1-yl at position 2, a formyl group at position 5 and a prenyl group at position 7. Isolated from Chaetomium globosum, it exhibits radical scavenging and cytotoxic activity towards several tumour cell lines.

[1aR-(1aalpha,4beta,4abeta,5beta,9aS*)]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 2-methyl-2-propenoic acid

Nagilactone F

A diterpene lactone isolated from Podocarpus latifolius and has been shown to exhibit inhibitory activity against activator protein 1 (AP-1).

6beta-(2-Methylacryloyloxy)-9-oxofuranoeremophilane

t-Crotonin

Eurotirumin

1,8-Dihydroxy-4-methyl-7-(3-methyl-2-butenyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromene-9-carbaldehyde

Hannokinol

(3S,5S)-1,7-bis(4-hydroxyphenyl)heptane-3,5-diol

(3S,5S)-1,7-bis(4-hydroxyphenyl)heptane-3,5-diol is a natural product found in Alpinia blepharocalyx, Alpinia roxburghii, and Centrolobium sclerophyllum with data available.

6-[(3E,5E,7S)-5,7-Dimethyl-2-oxo-3,5-nonadien-1-yl]-2,4-dihydroxy-3-methylbenzaldehyde

SCHEMBL4639890

14(??-Methyl butyryl)-2E,8E,10E-atractylentriol

methyl-3-(3,3-dimethylallyl)-4-isobutyryloxy-cinnamate|methyl-3-<3,3-dimethylallyl>-4-isobutyryloxy-cinnamate

(6R)-6-[(1E,4R,6R)-4,5-dihydroxy-8-phenyloct-1-en-1-yl]-5,6-dihydro-2H-pyran-2-one|6R-(4R,6R-dihydroxy-8-phenyloct-1-enyl)-5,6-dihydro-2-pyrone|strictifolione

(1S,3R,5S,7S)-1,7-diphenylheptan-1,3,5,7-tetraol|diospongin C

7alpha,12beta-dihydroxy-1,4-androstadiene-3,17-dione

SCHEMBL18285081

2,2-Dimethyl-5-methoxy-6-(3-methyl-2-butenyl)-8-acetyl-2H-1-benzopyran-7-ol

4-methoxy-3-(3-methyl-4-angelyoxy-but-2-en-1-yl)-acetophenone|4-methoxy-3-<3-methyl-4-angelyoxy-but-2-en-1-yl>-acetophenone

(E)-3-(2,2-dimethyl-3,4-dihydro-3-hydroxy-8-prenyl-2H-1-benzopyran-6-yl)-2-propenoic acid

Euryopsonol-2-methylacrylat

Di-Ac-(Z)-1,9-Pentadecadiene-4,6-diyne-3,8-diol

13-acetyl-12-hydroxypodocarpa-9(11),8(14),12-trien-15-oic acid

C19H24O4

clerodermic acid

3,3-Dimethoxy-5-ethyl-5-propylbiphenyl-2,2-diol

11,12,16-Trihydroxy-20-nor-abieta-5(10),8,11,13-tetraen-1-one|15R-11,12,16-Trihydroxy-20-nor-5(10),8,11,13-abietatetraen-1-one

1,2-Dihydro-Perrottetin B|Perrottetin C

ethuliconyzone

Fujenal

(3S,4E,6E,12E)-1-Isovaleryloxy-tetradeca-4,6,12-triene-8,10-diyne-3,14-diol

(4E,6E,12E)-3-Isovaleryloxy-tetradeca-4,6,12-triene-8,10-diyne-1,14-diol

Methyl nimbionone

DTXSID10958109

6,13-diacetoxy-pentadeca-1,7t-diene-9,11-diyne|Di-Ac-(E)-8,14-Pentadecadiene-4,6-diyne-3,10-diol

Artepillin A

SCHEMBL3160

14-propioyloxycacalohastin

Ferutinin

2,3-Epoxide,1-Ac-(8E,15Z)-2,9,16-Heptadecatriene-4,6-diyne-1,11-diol

fersin

17-nor-15-oxo-8,11,13-abietatrien-7alpha-hydroxy-18-oic acid|abiesanordine K

NSC317302

haplonolide

9-trans-p-coumaroyloxy-alpha-terpineol

(3S)-1-(4-hydroxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-ol|4-[(5S)-5-hydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol

oopodin

isocaproylbitalin A

6-(2-Methylpropanoyl)-(4beta,6beta)-4,15-Epoxyfuranoeremophil-1(10)-en-6-ol

Ferujol

(E)-6-(3,7-dimethylocta-2,6-dienyl)-7-hydroxy-5-methoxyisobenzofuran-1(3H)-one|hericenone J

lettowipyraquinol|methyl [6-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-2H-chromen-8-yl]acetate

2-Methoxy-4-[2-(2-hydroxy-3-methoxy-5-propylphenyl)ethyl]phenol

2-Methylpropanoyl-Chrysostomalide

(-)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-ol|(3R)-1-(3,4-dihedroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-ol|(3R)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-ol

Ferungin|ferutinin

14-Nor-7,15-dioxo-12-tiglyloxytrix-4-ene

(E)-3-<2,3-dihydro-2-(1-hydroxy-1-methylethyl)-7-prenyl-benzofuran-5-yl>-2-propenoic acid

1-Angeloyl-(1alpha,7beta)-1-Hydroxy-4(15),11(13)-eudesmadien-12-oic acid

Carnosol

13-hydroxy-15-oxozoapatlin

6-<1-(Angeloyloxy)ethyl>-7-methoxy-2,2-dimethyl-2H-chromen|6-[1-(Angeloyloxy)ethyl]-7-methoxy-2,2-dimethyl-2H-chromen|Angeloyl-Encecalinol|encecalol angelate

(S)-Franklinol

(alphaE)-3-(10-Hydroxygeranyl)-p-coumaric acid

Detoxin A1

HYPERGUINONE A

Asn Gly Leu

Gln Gly Ile

Val Ala Gln

Gln Val Ala

AG-879

Tyrphostin AG 879

C18H24N2OS (316.1609254)

Gly Asn Leu

Gln Ala Val

Gln Ile Gly

Ala Ile Asn

Ala Gln Val

Gly Leu Asn

Asn Ile Ala

Gly Gln Ile

Ile Ala Asn

Gly Ile Gln

Ala Val Gln

Val Gln Ala

Asn Ala Ile

Asn Leu Gly

Ile Gln Gly

Ala Asn Ile

1,7-bis(4-hydroxyphenyl)heptane-3,5-diol

NCGC00380746-01!1,7-bis(4-hydroxyphenyl)heptane-3,5-diol

4-[4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diol

NCGC00384965-01!4-[4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diol

C19H24O4_Benzaldehyde, 6-[(3E,5E,7S)-5,7-dimethyl-2-oxo-3,5-nonadien-1-yl]-2,4-dihydroxy-3-methyl

NCGC00169089-04_C19H24O4_Benzaldehyde, 6-[(3E,5E,7S)-5,7-dimethyl-2-oxo-3,5-nonadien-1-yl]-2,4-dihydroxy-3-methyl-

C19H24O4_11a-Hydroxy-4,4,9-trimethyl-9-vinyl-1,2,3,4,9,10,11,11a-octahydrodibenzo[c,e]oxepine-5,7-dione

NCGC00380965-01_C19H24O4_11a-Hydroxy-4,4,9-trimethyl-9-vinyl-1,2,3,4,9,10,11,11a-octahydrodibenzo[c,e]oxepine-5,7-dione

1,7-bis(4-hydroxyphenyl)heptane-3,5-diol

Sodium tetradecyl sulfate

C14H29NaO4S (316.1684154)

C - Cardiovascular system > C05 - Vasoprotectives > C05B - Antivaricose therapy > C05BB - Sclerosing agents for local injection D019999 - Pharmaceutical Solutions > D012597 - Sclerosing Solutions D013501 - Surface-Active Agents D002317 - Cardiovascular Agents

heminordihydroguaiaretic acid

1,7-bis(4-hydroxyphenyl)heptane-3,5-diol_major

heminordihydroguaiaretic acid_major

Ala Ala Gly Val

(2S)-2-{2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]acetamido}-3-methylbutanoic acid

Ala Ala Val Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-3-methylbutanamido]acetic acid

Ala Gly Ala Val

(2S)-2-[(2S)-2-{2-[(2S)-2-aminopropanamido]acetamido}propanamido]-3-methylbutanoic acid

Ala Gly Gly Ile

(2S,3S)-2-(2-{2-[(2S)-2-aminopropanamido]acetamido}acetamido)-3-methylpentanoic acid

Ala Gly Gly Leu

(2S)-2-(2-{2-[(2S)-2-aminopropanamido]acetamido}acetamido)-4-methylpentanoic acid

Ala Gly Ile Gly

2-[(2S,3S)-2-{2-[(2S)-2-aminopropanamido]acetamido}-3-methylpentanamido]acetic acid

Ala Gly Leu Gly

2-[(2S)-2-{2-[(2S)-2-aminopropanamido]acetamido}-4-methylpentanamido]acetic acid

Ala Gly Val Ala

(2S)-2-[(2S)-2-{2-[(2S)-2-aminopropanamido]acetamido}-3-methylbutanamido]propanoic acid

Ala Ile Gly Gly

2-{2-[(2S,3S)-2-[(2S)-2-aminopropanamido]-3-methylpentanamido]acetamido}acetic acid

Ala Leu Gly Gly

2-{2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]acetamido}acetic acid

Ala Val Ala Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanamido]propanamido]acetic acid

Ala Val Gly Ala

(2S)-2-{2-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanamido]acetamido}propanoic acid

Gly Ala Ala Val

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)propanamido]propanamido]-3-methylbutanoic acid

Gly Ala Gly Ile

(2S,3S)-2-{2-[(2S)-2-(2-aminoacetamido)propanamido]acetamido}-3-methylpentanoic acid

Gly Ala Gly Leu

(2S)-2-{2-[(2S)-2-(2-aminoacetamido)propanamido]acetamido}-4-methylpentanoic acid

Gly Ala Ile Gly

2-[(2S,3S)-2-[(2S)-2-(2-aminoacetamido)propanamido]-3-methylpentanamido]acetic acid

Gly Ala Leu Gly

2-[(2S)-2-[(2S)-2-(2-aminoacetamido)propanamido]-4-methylpentanamido]acetic acid

Gly Ala Val Ala

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)propanamido]-3-methylbutanamido]propanoic acid

Gly Gly Ala Ile

(2S,3S)-2-[(2S)-2-[2-(2-aminoacetamido)acetamido]propanamido]-3-methylpentanoic acid

Gly Gly Ala Leu

(2S)-2-[(2S)-2-[2-(2-aminoacetamido)acetamido]propanamido]-4-methylpentanoic acid

Gly Gly Ile Ala

(2S)-2-[(2S,3S)-2-[2-(2-aminoacetamido)acetamido]-3-methylpentanamido]propanoic acid

Gly Gly Leu Ala

(2S)-2-[(2S)-2-[2-(2-aminoacetamido)acetamido]-4-methylpentanamido]propanoic acid

Gly Ile Ala Gly

2-[(2S)-2-[(2S,3S)-2-(2-aminoacetamido)-3-methylpentanamido]propanamido]acetic acid

Gly Ile Gly Ala

(2S)-2-{2-[(2S,3S)-2-(2-aminoacetamido)-3-methylpentanamido]acetamido}propanoic acid

Gly Leu Ala Gly

2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-methylpentanamido]propanamido]acetic acid

Gly Leu Gly Ala

(2S)-2-{2-[(2S)-2-(2-aminoacetamido)-4-methylpentanamido]acetamido}propanoic acid

Gly Val Ala Ala

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-methylbutanamido]propanamido]propanoic acid

Asn Leu Ala

Ile Ala Gly Gly

2-{2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]propanamido]acetamido}acetic acid

Ile Gly Ala Gly

2-[(2S)-2-{2-[(2S,3S)-2-amino-3-methylpentanamido]acetamido}propanamido]acetic acid

Ile Gly Gly Ala

(2S)-2-(2-{2-[(2S,3S)-2-amino-3-methylpentanamido]acetamido}acetamido)propanoic acid

Ile Gly Gln

Gln Leu Gly

Leu Asn Ala

Leu Ala Gly Gly

2-{2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]propanamido]acetamido}acetic acid

Leu Gly Ala Gly

2-[(2S)-2-{2-[(2S)-2-amino-4-methylpentanamido]acetamido}propanamido]acetic acid

Leu Gly Gly Ala

(2S)-2-(2-{2-[(2S)-2-amino-4-methylpentanamido]acetamido}acetamido)propanoic acid

Leu Gln Gly

Ala Asn Leu

Ala Leu Asn

Gly Leu Gln

Ile Asn Ala

Leu Ala Asn

Gln Gly Leu

Leu Gly Gln

Asn Ala Leu

Gly Gln Leu

Val Ala Ala Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]propanamido]propanamido]acetic acid

Val Ala Gly Ala

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]propanamido]acetamido}propanoic acid

Val Gly Ala Ala

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-methylbutanamido]acetamido}propanamido]propanoic acid

Isopulegone caffeate

[4-(prop-1-en-2-yl)cyclohexyl]methyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

ST 19:4;O4

3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione

Tomoxiprole

Sotradecol

Sodium tetradecyl sulfate

C14H29NaO4S (316.1684154)

D019999 - Pharmaceutical Solutions > D012597 - Sclerosing Solutions C78275 - Agent Affecting Blood or Body Fluid D013501 - Surface-Active Agents D002317 - Cardiovascular Agents

TERT-BUTYL 2,7-DIAZASPIRO[3.5]NONANE-2-CARBOXYLATE OXALATE

Azepino[4,5-b]indole-5-carboxylic acid, 8-fluoro-1,2,3,6-tetrahydro-1,1-dimethyl-, 1-methylethyl ester

Azepino[4,5-b]indole-5-carboxylic acid, 9-fluoro-1,2,3,6-tetrahydro-1,1-dimethyl-, 1-methylethyl ester

2-O-benzyl 1-O-butyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate

C19H16D4O4 (316.161260712)

Suloxifen

C18H24N2OS (316.1609254)

Ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole-3-carboxylate

C16H21BN2O4 (316.1594296)

Ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-pyrrolo[ 2,3-b]pyridine-2-carboxylate

C16H21BN2O4 (316.1594296)

Androst-4-en-19-oicacid, 3,17-dioxo-

Thiourea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-cyclohexyl-N-methyl- (9CI)

C17H24N4S (316.1721584)

tert-butyl 4-(2-methoxy-2-oxoethyl)-4-(nitromethyl)piperidine-1-carboxylate

C15H20N6O2

Navoximod

C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent C308 - Immunotherapeutic Agent > C141144 - Immune Checkpoint Modulator C471 - Enzyme Inhibitor > C141137 - IDO1 Inhibitor C274 - Antineoplastic Agent

N-Boc-N-[(Allyloxy)carbonyl]-L-ornithine

Ethoxylated bisphenol A

16-Hydroxy-19-oxo-4-androsten-3,17-dione

D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones

5H-Imidazo[5,1-a]isoindole-5-ethanol, 6-fluoro-alpha-(trans-4-hydroxycyclohexyl)-

Leu-Gln-Gly

11beta,13-Dihydroxy-3-oxo-13,17-secoandrosta-1,4-dien-17-oic acid delta-lactone

11beta,13-Dihydroxy-3-oxo-13,17-secoandrosta-1,4-dien-17-oic acid, delta-lactone

4-[4-(4-Hydroxy-3-methoxyphenyl)-2,3-dimethylbutyl]pyrocatechol

(1R,2R,5R,8R,9S,10R,11S)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid

3,17-dihydroxy-13-methyl-2-oxo-6,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1-carbaldehyde

[3-carboxy-2-[(E)-7-carboxyhept-6-enoyl]oxypropyl]-trimethylazanium

[3-carboxy-2-[(E)-7-carboxyhept-4-enoyl]oxypropyl]-trimethylazanium

[3-carboxy-2-[(E)-7-carboxyhept-5-enoyl]oxypropyl]-trimethylazanium

[3-carboxy-2-[(E)-7-carboxyhept-2-enoyl]oxypropyl]-trimethylazanium

6-[(3E,5E,7S)-5,7-dimethyl-2-oxonona-3,5-dienyl]-2,4-dihydroxy-3-methylbenzaldehyde

Tyrphostin AG 879

C18H24N2OS (316.1609254)

D000970 - Antineoplastic Agents > D020032 - Tyrphostins

Bornyl caffeate

(-)-(3S)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-ol

A diarylheptanoid that is heptan-3-ol substituted by a 3,4-dihydroxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 (the 3S-stereoisomer). It has been isolated from the rhizomes of Curcuma kwangsiensis.

(+)-(3R)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-ol

A diarylheptanoid that is heptan-3-ol substituted by a 3,4-dihydroxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 (the 3R-stereoisomer). It has been isolated from the rhizomes of Curcuma kwangsiensis.

Tofranil

C19H25ClN2 (316.170616)

D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018759 - Adrenergic Uptake Inhibitors D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents D049990 - Membrane Transport Modulators

2-Naphthalenyl-(4-phenyl-1-piperazinyl)methanone

2-[[4-(2-Hydroxyethylamino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]phenol

Gly-Leu-Gln

2-(2-phenylanilino)-N-(phenylmethyl)acetamide

N-[4-(1-pyrrolidinyl)phenyl]-2-naphthalenecarboxamide

(+)-(8R,8R)-3,4,4-trihydroxy-3-methoxylignan

A natural product found in Machilus robusta.

1-[2-[Cyano-(4,6-dimethyl-2-pyrimidinyl)amino]-1-oxoethyl]-4-piperidinecarboxamide

N-[1,3-dimethyl-2-oxo-5-[[oxo(propoxy)methyl]amino]-4-imidazolidinyl]carbamic acid propyl ester

2-anilino-N-(4-methylphenyl)-2-phenylacetamide

Ala-Asn-Leu

Leu-Ala-Asn

Leu-Asn-Ala

Ala-Leu-Asn

Asn-Ala-Ile

Asn-Leu-Ala

6-De(cyclopropylamino)-6-(3-methoxyazetidin-1-yl)abacavir

Ala-Ile-Asn

Ala-Val-Gln

Gln-Ile-Gly

Gln-Leu-Gly

Gly-Gln-Leu

Ile-Asn-Ala

Ile-Gly-Gln

Ala-Asn-Ile

Ala-Gln-Val

Asn-Ala-Leu

Asn-Ile-Ala

Gln-Ala-Val

Gln-Gly-Ile

Gln-Gly-Leu

Gln-Val-Ala

Gly-Gln-Ile

Gly-Ile-Gln

Ile-Ala-Asn

Ile-Gln-Gly

Leu-Gly-Gln

Val-Ala-Gln

Val-Gln-Ala

O-suberoylcarnitine(1-)

C15H26NO6- (316.1760036)

A dicarboxylic acid monoanion that is the conjugate base of O-suberoylcarnitine; major spoecies at pH 7.3.

(11R)-19-oxocarlactone

2-[(3S)-1-(1H-Indol-3-ylmethyl)-3-pyrrolidinyl]-1H-benzimidazole

C20H20N4 (316.168788)

[3-carboxy-1-[(E)-7-carboxyhept-2-enoyl]oxypropyl]-trimethylazanium

(3Z)-3-[(2E,6E,8E)-1-hydroxy-2,10-dimethyldodeca-2,6,8-trienylidene]-5-methylideneoxolane-2,4-dione

Bisphenol a ethoxylate

2,2-Bis(4-(2-hydroxyethoxy)phenyl)propane

Porphyrinogen

C20H20N4 (316.168788)

FAHFA 10:3/O-9:3

FAHFA 9:3/O-10:3

Dihydroxysecoandrostatrienedione

6-hydroxy-2-(3-hydroxybut-1-en-1-yl)-7-(3-methylbut-2-en-1-yl)-3,4-dihydro-2h-1-benzopyran-5-carbaldehyde

6-(5,7-dimethyl-2-oxonona-3,5-dien-1-yl)-2,4-dihydroxy-3-methylbenzaldehyde

6-(3,7-dimethylocta-2,6-dien-1-yl)-7-hydroxy-5-methoxy-3h-2-benzofuran-1-one

(1r,4as,10ar)-7-acetyl-6-hydroxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

(6r)-6-[(1e,4r,6r)-4,6-dihydroxy-8-phenyloct-1-en-1-yl]-5,6-dihydropyran-2-one

(2e)-3-[(2s)-2-[(2s)-1-hydroxypropan-2-yl]-7-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid

(3as,6ar,8s,9ar,9bs)-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-8-yl 2-methylpropanoate

(3s)-1-[(2r)-3,3-dimethyloxiran-2-yl]-3-ethenyl-5-(2-hydroxy-6-methylphenyl)-3-methylpentane-1,5-dione

(2e)-3-{4-hydroxy-3-[(2z)-4-hydroxy-3-(4-methylpent-3-en-1-yl)but-2-en-1-yl]phenyl}prop-2-enoic acid

5,6-dihydroxy-7-(1-hydroxypropan-2-yl)-1,1-dimethyl-2,3,9,10-tetrahydrophenanthren-4-one

(2r)-6-hydroxy-2-[(1r)-1-hydroxybut-2-en-1-yl]-7-(3-methylbut-2-en-1-yl)-3,4-dihydro-2h-1-benzopyran-5-carbaldehyde

1-[7-hydroxy-5-methoxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)chromen-8-yl]ethanone

(1s,2r,5r,8s,9r,12s,13s,17r)-12-hydroxy-13-methyl-4-methylidene-15-oxapentacyclo[7.7.1.1²,⁵.0²,⁸.0¹³,¹⁷]octadecane-14,16-dione

5'-(furan-3-yl)-2,5-dimethyl-octahydrospiro[naphthalene-1,3'-oxolane]-2',7-dione

3-(3,5-dimethylhepta-1,3-dien-1-yl)-7-methyl-1h-isochromene-1,6,8-triol

(3r,5s)-1,7-bis(4-hydroxyphenyl)heptane-3,5-diol

(1s,8r,11s,12s,15s)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-dien-11-yl 2-methylprop-2-enoate

[(1r,4r)-4-(prop-1-en-2-yl)cyclohexyl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(5s)-5-hydroxy-3-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-4-(2-methylpropyl)-5h-furan-2-one

4-ethoxy-6-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)-2-oxopyran-3-carbaldehyde

(1s)-1-{5-methoxy-2,2,8,8-tetramethylpyrano[3,2-g]chromen-10-yl}ethanol

(4s,4ar,5s)-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h-naphtho[2,3-b]furan-4-yl 2-methylpropanoate

(1s,9r,10s,12s,13r)-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-12-yl 2-methylprop-2-enoate

(3s,4 e,6 e,12e)-1-isovaleryloxy-tetradeca-4,6,12-triene-8,10-diyne-3,14-diol

{"Ingredient_id": "HBIN009634","Ingredient_name": "(3s,4 e,6 e,12e)-1-isovaleryloxy-tetradeca-4,6,12-triene-8,10-diyne-3,14-diol","Alias": "NA","Ingredient_formula": "C19H24O4","Ingredient_Smile": "CC(C)CC(=O)OC(CCO)C=CC=CC#CC#CC=CCO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "11761","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(3s,5s)-3,5-dihydroxy-1,7-bis(4-hydroxyphenyl)heptane

{"Ingredient_id": "HBIN009666","Ingredient_name": "(3s,5s)-3,5-dihydroxy-1,7-bis(4-hydroxyphenyl)heptane","Alias": "NA","Ingredient_formula": "C19H24O4","Ingredient_Smile": "C1=CC(=CC=C1CCC(CC(CCC2=CC=C(C=C2)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5779","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(4 e,6 e,12e)-3-isovaleryloxy-tetradeca-4,6,12-triene-8,10-diyne-1,14-diol

{"Ingredient_id": "HBIN010338","Ingredient_name": "(4 e,6 e,12e)-3-isovaleryloxy-tetradeca-4,6,12-triene-8,10-diyne-1,14-diol","Alias": "NA","Ingredient_formula": "C19H24O4","Ingredient_Smile": "CC(C)CC(=O)OC(CCO)C=CC=CC#CC#CC=CCO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "11760","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

Artepillin A

artepillin a

{"Ingredient_id": "HBIN016972","Ingredient_name": "Artepillin A","Alias": "artepillin a","Ingredient_formula": "C19H24O4","Ingredient_Smile": "CC(CO)C1CC2=C(O1)C(=CC(=C2)C=CC(=O)O)CC=C(C)C","Ingredient_weight": "316.4 g/mol","OB_score": "68.31719082","CAS_id": "NA","SymMap_id": "SMIT09381","TCMID_id": "1807","TCMSP_id": "MOL008047","TCM_ID_id": "6605","PubChem_id": "21626500","DrugBank_id": "NA"}

Atractyloyne

{"Ingredient_id": "HBIN017311","Ingredient_name": "Atractyloyne","Alias": "NA","Ingredient_formula": "C19H24O4","Ingredient_Smile": "CC(C)CC(=O)OCCC(C=CC=CC#CC#CC=CCO)O","Ingredient_weight": "316.4 g/mol","OB_score": "5.201145462","CAS_id": "NA","SymMap_id": "SMIT02831","TCMID_id": "NA","TCMSP_id": "MOL000182","TCM_ID_id": "NA","PubChem_id": "11544212","DrugBank_id": "NA"}

(1s,8s,9s,10s,13r)-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-8-yl 2-methylprop-2-enoate

(1's,2s,2'r,7'r,9'r,11'r)-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecane]-3',5'-dien-11'-yl (2z)-but-2-enoate

(2s,3s,6s,7r)-3,12-dihydroxy-7-methyl-11-(3-methylbut-2-en-1-yl)-8-oxatricyclo[7.4.0.0²,⁶]trideca-1(9),10,12-triene-13-carbaldehyde

(1r,2s,5r,8r,9s,10r,11r)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid