Exact Mass: 380.1947
Exact Mass Matches: 380.1947
Found 500 metabolites which its exact mass value is equals to given mass value 380.1947
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Fludrocortisone
Fludrocortisone is only found in individuals that have used or taken this drug. It is a synthetic mineralocorticoid with anti-inflammatory activity. [PubChem]Fludrocortisone binds the mineralocorticoid receptor (aldosterone receptor). This binding (or activation of the mineralocorticoid receptor by fludrocortisone) in turn causes an increase in ion and water transport and thus raises extracellular fluid volume and blood pressure and lowers potassium levels. H - Systemic hormonal preparations, excl. sex hormones and insulins > H02 - Corticosteroids for systemic use > H02A - Corticosteroids for systemic use, plain > H02AA - Mineralocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D000893 - Anti-Inflammatory Agents
Norbixin
Norbixin is a water-soluble food colour. Commercial forms contain mixtures of isomers and their methyl esters. Norbixin is used to colour butter, margarine and other fat-related products. Upon exposure to alkali, the bixins methyl ester is hydrolyzed to produce the dicarboxylic acid norbixin, a water-soluble derivative. Bixin is an apocarotenoid found in annatto, a natural food coloring obtained from the seeds of the achiote tree (Bixa orellana). (Wikipedia Water-soluble food colour. Commercial forms contain mixts. of isomers and their Me esters. It is used to colour butter, margarine and other fat-related products D000074385 - Food Ingredients > D005503 - Food Additives > D005505 - Food Coloring Agents D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D004396 - Coloring Agents
Cinncassiol C
Cinncassiol C is found in herbs and spices. Cinncassiol C is a constituent of Cinnamomum cassia (Chinese cinnamon)
Tokinolide A
Tokinolide A is found in green vegetables. Tokinolide A is a constituent of the roots of Angelica acutiloba (Dong Dang Gui).
Levistolide A
Levistolide B is found in herbs and spices. Levistolide B is a constituent of Levisticum officinale (lovage)
Pteroside B
Pteroside B is found in green vegetables. Pteroside B is a constituent of Pteridium aquilinum (bracken fern)
Gancaonin U
Gancaonin U is found in herbs and spices. Gancaonin U is a constituent of Glycyrrhiza uralensis (Chinese licorice). Constituent of Glycyrrhiza uralensis (Chinese licorice). Gancaonin U is found in herbs and spices.
Deacetylisovaltrate
Constituent of Valeriana officinalis (valerian). Deacetylisovaltrate is found in tea, fats and oils, and herbs and spices. Deacetylisovaltrate is found in fats and oils. Deacetylisovaltrate is a constituent of Valeriana officinalis (valerian)
Angelicolide
Angelicolide is found in herbs and spices. Angelicolide is a constituent of roots of Angelica glauca
Kinocoumarin
Kinocoumarin is found in citrus. Kinocoumarin is a constituent of Citrus medica (citron). Constituent of Citrus medica (citron). Kinocoumarin is found in citrus.
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables. 6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables.
(3'x,5'a,9'x,10'b)-O-(6-Oxo-7-drimen-11-yl)umbelliferone
(3x,5a,9x,10b)-O-(6-Oxo-7-drimen-11-yl)umbelliferone is found in herbs and spices. (3x,5a,9x,10b)-O-(6-Oxo-7-drimen-11-yl)umbelliferone is a constituent of Ferula galbaniflua (galbanum). Constituent of Ferula galbaniflua (galbanum). (3x,5a,9x,10b)-O-(6-Oxo-7-drimen-11-yl)umbelliferone is found in herbs and spices.
1-(9Z-tetradecenoyl)-glycero-3-phosphate
1-(9Z-tetradecenoyl)-glycero-3-phosphate is classified as a member of the 1-acylglycerol-3-phosphates. 1-acylglycerol-3-phosphates are lysophosphatidic acids where the glycerol is esterified with a fatty acid at O-1 position. 1-(9Z-tetradecenoyl)-glycero-3-phosphate is considered to be practically insoluble (in water) and acidic. 1-(9Z-tetradecenoyl)-glycero-3-phosphate is a glycerophosphate lipid molecule
(1S)-1-(3-Methoxyphenyl)-2-[4-[4-[(propan-2-ylideneamino)oxymethyl]phenyl]triazol-1-yl]ethanol
Fluorohydrocortisone
3-Methyl-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide
(8S,9R,10S,11R,13S,14S,17S)-9-Fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
TokinolideB
Tokinolide B is a natural product found in Ligusticum striatum, Ligusticum chuanxiong, and other organisms with data available.
29MRT0H4CE
(Z)-6,6,7,3a-Diligustilide is a butenolide. It has a role as a metabolite. Levistilide A is a natural product found in Ligusticum striatum, Angelica sinensis, and other organisms with data available. See also: Angelica sinensis root oil (part of). A natural product found in Ligusticum porteri. Levistolide A (LA), a natural compound isolated from the traditional Chinese herb Ligusticum chuanxiong Hort, is used for treating cancer. Levistolide A can induce apoptosis via ROS-mediated ER stress pathway[1]. Levistolide A (LA), a natural compound isolated from the traditional Chinese herb Ligusticum chuanxiong Hort, is used for treating cancer. Levistolide A can induce apoptosis via ROS-mediated ER stress pathway[1].
[3aS-(3aR*,4R*,5R*,6R*,10E,11aS*)]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-5,6-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 3-methylbutanoic acid
Neurolenin C
A germacranolide isolated from Neurolaena lobata and Austroeupatorium inulifolium and has been shown to exhibit antimalarial activity.
3beta,4alpha,7beta,10beta-Tetrahydroxy-15,16-epoxy-labda-13(16),14-dien-20,12-olide
Neurolenin D
A germacranolide isolated from Neurolaena lobata and Austroeupatorium inulifolium and has been shown to exhibit antimalarial activity.
3alpha,4beta,8beta,10beta-Tetrahydroxy-15,16-epoxy-cis-clerodane-13(16),14-dien-20,12-olide
[3aR-[3aalpha,4beta(S*),6alpha,6aalpha,7beta,7abeta,8abeta,8balpha,8cbeta]]-Dodecahydro-6,7-dihydroxy-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid
[3aR-(3aalpha,4beta,6alpha,6aalpha,7beta,7abeta,8abeta,8balpha,8cbeta)]-Dodecahydro-6,7-dihydroxy-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester 3-methylbutanoic acid
(7E)-1-[(1E)-5-hydroxypent-1-en-1-yl]non-7-ene-3,5-diyn-1-yl beta-D-glucopyranoside|9-(beta-D-glucopyranosyloxy)tetradeca-2,10-diene-4,6-diyn-14-ol|cordifolioidyne C
8alpha-hydroxy-7,11-dehydro-senatractolide-6-O-2-methylbutyrate
2alpha-isovaleryloxy-3,8-dioxo-11-peroxy-4beta,5beta-epoxybisabola-8(14),9E-diene
8alpha-hydroxy-7,11-dehydro-senatractolide-6-O-isovalerate
2,4-dihydroxy-6-methoxy-3,5-di-(3-methylbut-2-enyl)-benzophenone|2,4-dihydroxy-6-methoxy-3,5-diprenylbenzophenone|Vismiaphenone A
7-(2-Methylbutanoyl),9-angeloyl: p-Mentha-1,3,5-triene-3,7,8,9,10-penol|9-Angeloyloxy-7-(2-methylbutyryloxy)-8,10-dihydroxy-thymol
6beta,7beta,12alpha,14beta,18-pentahydroxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|parvifoline P
1beta-hydroxy-8-desacylzacatechinolide-(2-methyl butyrate)
Cinnamoyl(E-)-15-Hydroxy-3,11(13)-eudesmadien-12-oic acid
methyl 3,5-di-O-(3-methyl-(E)-2-pentenoyl)shikimate
(1S,3R,6R,7R,8R,10R)-1-hydroxy-3-methoxy-3,10-epoxy-8-isobutyryloxygermacra-4,11(13)-dien-6,12-olide|TD-6
8alpha-Angeloyloxy-1beta,10alpha-epoxy-2alpha,15-dihydroxy-11betaH-germacr-4Z-en-12,6alpha-olide
8alpha-O-(4-hydroxy-2-methylenebutanoyloxy)-11beta,13-dihydrosonchucaprolide|8alpha-O-(4-hydroxy-2-methylenebutanoyloxy)-11beta,13-dihydrosonchucarpolide
6beta,7beta,11beta,14beta,18-pentahydroxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|parvifoline O
(+/-)-cis-1,2-Bis((E)-3,4-dimethoxystyryl)cyclobutane|(+/-)-cis-1,2-Bis<(E)-3,4-dimethoxystyryl>cyclobutane|(1RS,2SR)-(E,E)-1,2-Bis[2-(3,4-dimethoxyphenyl)ethenyl]cyclobutane
3-(3,4-dimethoxy-phenyl)-4-(3,4-dimethoxystyryl)cyclohexene
hypargystilbene A|rel-(6aS,12aR)-2-(1,1-dimethylprop-2-en-1-yl)-6a,7,12,12a-tetrahydro-6,6-dimethyl-6H-benzo[b]naphtho[2,3-d]pyran-3,8,10-triol
CC(=CCC1=C(C=C(C=C1OCC=C(C)C)O)C=CC1=CC(=C(C=C1)O)O)C
(E)-2,4-di(3-methyl-2-buten-1-yl)-3,3,4,5-tetrahydroxystilbene
(E)-2,6-di(3-methyl-2-buten-1-yl)-3,3,5,5-tetrahydroxystilbene
(4S,4aS,5R,6S,8aS,9aR)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-4,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl (2E)-2-methylbut-2-enoate|6beta,8alpha,10beta-trihydroxy-3-[((E)-2-methylbut-2-enoyl)oxy]eremophilenolide|hertidin D
3alpha,10alpha,13alpha,16alpha,17-pentahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|3??,10??,13??,16??,17-Pentahydroxy-9??-methyl-15-oxo-20-nor-kaur-an-19-oic acid ??-lactone
(4S,4aS,5R,6S,8aS,9aR)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-4,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl 3-methylbut-2-enoate|6beta,8alpha,10beta-trihydroxy-3-[(3-methylbut-2-enoyl)oxy]eremophilenolide|hertidin C
7alpha,8alpha-epoxy-senatractolide-6-O-isovalerate
2-alpha-hydroxyeudesma-4,11(13)-dien-12,8beta-olide-2-O-beta-D-xylopyranoside
methyl 4,5-di-O-(3-methyl-(E)-2-pentenoyl)shikimate
1??,7??,10??,13??-Tetrahydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
(E)-4-[3,5-dihydroxy-2,6-bis(3-methylbut-2-enyl)styryl]benzene-1,2-diol|artochamin F
9alpha-hydroxy-3Z-seco-ratiferolide-5alpha-O-(2-methylbutyrate)|9alpha-hydroxy-3Z-seco-ratiferolide-5alpha-O-<2-methylbutyrate>
2alpha,10alpha,13alpha,16alpha,17-pentahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone|2alpha,10alpha,13alpha,16alpha,17-pentahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|2??,10??,13??,16??,17-Pentahydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone
(5R,6R,7R,8S,10S,11S)-15-hydroxy-8-(1,2-dihydroxyethyl)-acryloxyelema-1,3-dien-6,12-olide
10-(1-Ethenyl-1, 5-dimethyl-4-hexenyl)-5-hydroxy-8, 8-dimethyl-2H, 8H-benzo[1, 2-b:5, 4-b]dipyran-2-one, 9CI|5-hydroxy-8,8-dimethyl-10-(3,7-dimethylocta-1,6-dien-3-yl)-2H,8H-benzo<1,2-b:5,4-b>dipyran-2-one
2,3,14-Triacetoxy-8,17-epoxy-9-hydroxy-5,11-briaradien-18,7-olide
[3-(3,7-dimethyl-2,6-octadienyl)-2,4-dihydroxy-6-methoxyphenyl]phenylmethanone
1beta,3beta-Dihydroxy-6alpha-(2-hydroxymethylacryloyloxy)costic acid methyl ester
9alpha-hydroxy-seco-ratiferolide-5alpha-O-(2-methylbutyrate)
Angelicide
Angelicide is a natural product found in Ligusticum striatum and Ligusticum chuanxiong with data available.
5-hydroxy-2,2-dimethyl-7,10-bis(2-methylbut-3-en-2-yl)pyrano[3,2-g]chromen-8-one
C20H28O7_2-Butenoic acid, 4-hydroxy-2-methyl-, (1R,5S,6S)-3-(hydroxymethyl)-6-(1-methylethyl)-5-[[(2Z)-2-methyl-1-oxo-2-buten-1-yl]oxy]-2-oxo-3-cyclohexen-1-yl ester, (2E)
C19H28N2O6_1-{5-O-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]pentofuranosyl}-2,4(1H,3H)-pyrimidinedione
[(1R,5S,6S)-3-(hydroxymethyl)-5-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] (E)-4-hydroxy-2-methylbut-2-enoate
5-hydroxy-2,2-dimethyl-7,10-bis(2-methylbut-3-en-2-yl)pyrano[3,2-g]chromen-8-one [IIN-based: Match]
5-hydroxy-2,2-dimethyl-7,10-bis(2-methylbut-3-en-2-yl)pyrano[3,2-g]chromen-8-one [IIN-based on: CCMSLIB00000848891]
[(1R,5S,6S)-3-(hydroxymethyl)-5-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] (E)-4-hydroxy-2-methylbut-2-enoate_major
Angelicolide
Pteroside B
Isodiospyrin
Levistolide A (LA), a natural compound isolated from the traditional Chinese herb Ligusticum chuanxiong Hort, is used for treating cancer. Levistolide A can induce apoptosis via ROS-mediated ER stress pathway[1]. Levistolide A (LA), a natural compound isolated from the traditional Chinese herb Ligusticum chuanxiong Hort, is used for treating cancer. Levistolide A can induce apoptosis via ROS-mediated ER stress pathway[1].
Cinncassiol C
Valepotriate a1
Gancaonin U
Kinocoumarin
A member of the class of coumarins that is 2H,8H-pyrano[3,2-g]chromen-2-one substituted by geminal methyl groups at position 8, a hydroxy group at position 5, and a 2-methylbut-3-en-2-yl group at positions 7 and 10.
(3'x,5'a,9'x,10'b)-O-(6-Oxo-7-drimen-11-yl)umbelliferone
Tokinolide A
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide
fludrocortisone
H - Systemic hormonal preparations, excl. sex hormones and insulins > H02 - Corticosteroids for systemic use > H02A - Corticosteroids for systemic use, plain > H02AA - Mineralocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D000893 - Anti-Inflammatory Agents
2-(4-BOC-PIPERAZINYL)-2-(3,4-DIMETHOXY-PHENYL)ACETIC ACID
4-[CARBOXY-(4-FLUORO-PHENYL)-METHYL]-PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTERHYDROCHLORIDE
Urea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-cyclohexyl-N-(2-fluorophenyl)- (9CI)
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoic acid
4-Methylphenyl 4-[(trans-4-propylcyclohexyl)carbonyloxy]benzoate
6-nitro-N-[2-(4-pentoxyphenyl)ethyl]quinazolin-4-amine
(10-Phenyl-9-anthracenyl)boronic acid pinacol ester
diethylstilbestrol dipropionate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen
2-(4-Boc-piperazinyl)-α-(2,3-dimethoxy-phenyl)acetic acid
2-(4-Boc-piperazinyl)-α-(3,5-dimethoxy-phenyl)acetic acid
2,5-Furandione, polymer with 2,2-(1,2-ethanediylbis(oxy))bis(ethanol) and 3a,4,7,7a-tetrahydro-4,7-methano-1H-indene
Oxyphencyclimine hydrochloride
C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent
6-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
N2-(4-fluorophenyl)-6-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,3,5-triazine-2,4-diamine
7-[[(1R,8aS)-2,5,5,8a-tetramethyl-6-oxo-4,4a,7,8-tetrahydro-1H-naphthalen-1-yl]methoxy]chromen-2-one
7-[[(1R,4aS,8aR)-2,5,5,8a-tetramethyl-6-oxo-4,4a,7,8-tetrahydro-1H-naphthalen-1-yl]methoxy]chromen-2-one
[(2R)-2-hydroxy-3-phosphonooxypropyl] (Z)-tetradec-7-enoate
5,11-Dihydro-11-[[4-(2-aminoethyl)-1-piperazinyl]acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
3-(3,4-dimethoxyphenyl)-4-[(E)-3,4-dimethoxystyryl]cyclohex-1-ene
A natural product found in Zingiber cassumunar.
2-[(4E)-4-[(1-ethyl-2,5-dimethylpyrrol-3-yl)methylidene]-2,5-dioxoimidazolidin-1-yl]-N-(3-methylphenyl)acetamide
2-Cyano-2-[3-(4-morpholinyl)-2-quinoxalinyl]acetic acid cyclohexyl ester
2-methoxy-6-[4-[2-(4-morpholinyl)ethylamino]-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone
2-amino-1-[2-(4-morpholinyl)ethyl]-N-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide
3-(3,4-dimethoxyphenyl)-4-[(Z)-3,4-dimethoxystyryl]cyclohex-1-ene
A natural product found in Zingiber cassumunar.
2-(2-Fluoro-5-methoxyphenyl)-5-methyl-4-[(4-phenyl-1-piperidinyl)methyl]oxazole
2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2R,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
(1S,2aR,8bR)-1-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-N-propyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
(6R,7S,8S)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8S)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8S)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
[(2R,3S)-1-(cyclopropylmethyl)-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-(2-fluorophenyl)methanone
[(2S,3R)-1-(cyclopropylmethyl)-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-(2-fluorophenyl)methanone
2-[(2R,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2R,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxy-1-oxoethyl)amino]-2-oxanyl]-N-[(2-methoxyphenyl)methyl]acetamide
(1R,2aS,8bS)-1-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-N-propyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
[(1R,5S)-7-[4-(2-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-(4-oxanyl)methanone
(6S,7S,8R)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7S,8R)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7R,8S)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8R)-4-[(4-fluorophenyl)methyl]-8-(hydroxymethyl)-7-[4-[(E)-prop-1-enyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
[(2S,3S)-1-(cyclopropylmethyl)-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-(2-fluorophenyl)methanone
[(2R,3R)-1-(cyclopropylmethyl)-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-(2-fluorophenyl)methanone
6-[(2Z)-2-benzylideneheptoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
(2-hydroxy-3-phosphonooxypropyl) (Z)-tetradec-9-enoate
(3x,5a,9x,10b)-O-(6-Oxo-7-drimen-11-yl)umbelliferone
1-Myristoyl-sn-glycerol 3-phosphate(2-)
An anionic phospholipid obtained by deprotonation of the phosphate OH groups of 1-myristoyl-sn-glycerol 3-phosphate.
(1r,2r,4s,5r,6s,9s,10s,11s,13r,14s)-2-hydroxy-2,6,11-trimethyl-7-oxo-8,12,15-trioxapentacyclo[8.5.0.0¹,¹⁴.0⁵,⁹.0¹¹,¹³]pentadecan-4-yl 3-methylbutanoate
7-(but-2-enoyl)-5,7-dihydroxy-6-methyl-3-methylidene-2-oxo-hexahydrocyclohepta[b]furan-8-yl 2-methylbutanoate
7-hydroxy-3-[(3e)-3,7,11-trimethyl-9-oxododeca-3,6,10-trien-2-yl]chromen-2-one
10-hydroperoxy-6,15a-dihydroxy-3,6,10,14-tetramethyl-7h,11h,12h,13h,14h-cyclotetradeca[b]furan-2,15-dione
(3r,3as,5r,6s,7s,8s,8ar)-7-[(2e)-but-2-enoyl]-5,7-dihydroxy-3,6-dimethyl-2-oxo-hexahydro-3h-cyclohepta[b]furan-8-yl (2e)-2-methylbut-2-enoate
5,6-dihydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3ah,4h,5h,8h,11h,11ah-cyclodeca[b]furan-4-yl 3-methylbutanoate
1,12-dihydroxy-2-(hydroxymethyl)-11-methyl-9-[(2-methylbut-2-en-1-yl)oxy]-7-methylidene-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-6-one
5,6-dihydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3ah,4h,5h,10h,11h,11ah-cyclodeca[b]furan-4-yl 3-methylbutanoate
6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-3h-inden-1-one
10-(3,7-dimethylocta-1,6-dien-3-yl)-5-hydroxy-8,8-dimethylpyrano[3,2-g]chromen-2-one
(3r)-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-3h-inden-1-one
2-benzoyl-3,5-dihydroxy-6-methyl-4,4-bis(3-methylbut-2-en-1-yl)cyclohexa-2,5-dien-1-one
(1r,2s,3s,7s,9r,13s,14r,15r,16r,17s)-3,15,16-trihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadec-5-ene-4,11-dione
(3as,4r,10s,11ar)-6-(hydroxymethyl)-10-methyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9h,10h,11h,11ah-cyclodeca[b]furan-4-yl (2e)-4-hydroxy-2-(hydroxymethyl)but-2-enoate
8,9-dihydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradecan-2-yl 2-methylbut-2-enoate
(1s,2z,4r,8r,9r,11s)-1-hydroxy-2-(hydroxymethyl)-11-methyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-9-yl (2r)-2-methylbutanoate
(1s,2s,5s,8r,9s,10s,11r,15s,16r,18r)-9,10,15,16,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(4s,4as,5r,6s,8as,9ar)-4,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-6-yl (2e)-2-methylbut-2-enoate
7-[(5,5,8a-trimethyl-2-methylidene-6-oxo-hexahydronaphthalen-1-yl)methoxy]chromen-2-one
(1s,2z,4r,8r,9r,11r)-1-hydroxy-2-(hydroxymethyl)-11-methyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-9-yl (2r)-2-methylbutanoate
1-[(2r,3r,4s,5r)-5-({[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}methyl)-3,4-dihydroxyoxolan-2-yl]-4-hydroxypyrimidin-2-one
6-hydroxy-5a-methyl-3,9-dimethylidene-2-oxo-octahydronaphtho[1,2-b]furan-4-yl 2,3-dihydroxy-2-methylbutanoate
(1s,2r,4s,6r,8s,9s,11r)-8,9-dihydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradecan-2-yl (2z)-2-methylbut-2-enoate
(1r,2s,4s,5r,8r,9s,10s,11r,12s,18r)-4,9,10,18-tetrahydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
1-(5-{[(3,7-dimethylocta-2,6-dien-1-yl)oxy]methyl}-3,4-dihydroxyoxolan-2-yl)-4-hydroxypyrimidin-2-one
5-[2-(2,4-dihydroxyphenyl)ethenyl]-2-(3,7-dimethylocta-2,6-dien-1-yl)benzene-1,3-diol
6,9,17-trihydroxy-7,7,17-trimethyl-3,10-dioxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁸,¹²]nonadecane-2,18-dione
6,9,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-4-yl 2-methylbut-2-enoate
(6as,12ar)-6,6-dimethyl-2-(2-methylbut-3-en-2-yl)-6a,7,12,12a-tetrahydro-5-oxatetraphene-3,8,10-triol
4-benzoyl-2-(3,7-dimethylocta-2,6-dien-1-yl)-5-methoxybenzene-1,3-diol
2-(3,7-dimethylocta-2,6-dien-1-yl)-5-(6-hydroxy-2,3-dihydro-1-benzofuran-2-yl)benzene-1,3-diol
5,6,13-trihydroxy-6-(hydroxymethyl)-2,12-dimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
6,9a-dihydroxy-3,5a-dimethyl-9-methylidene-2-oxo-octahydronaphtho[1,2-b]furan-4-yl 3-hydroxy-2-methylidenebutanoate
8,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl 2-methylbut-2-enoate
(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-{[(4e,6r,12e)-1-hydroxytetradeca-4,12-dien-8,10-diyn-6-yl]oxy}oxane-3,4,5-triol
(3s,3ar,4s,5ar,6r,9s,9as,9br)-9-formyl-6-hydroxy-3,5a-dimethyl-2-oxo-decahydronaphtho[1,2-b]furan-4-yl 4-hydroxy-2-methylidenebutanoate
11-dehydroklaineanone
{"Ingredient_id": "HBIN000385","Ingredient_name": "11-dehydroklaineanone","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1C(C(C2C3(C(CC4C2(C1(CC(=O)O4)O)C)C(=CC(=O)C3O)C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4937","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
15β-hydroxyklaineanone
{"Ingredient_id": "HBIN001629","Ingredient_name": "15\u03b2-hydroxyklaineanone","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1C2C(C(=O)OC3C2(C(C(C1O)O)C4(C(C3)C(=CC(=O)C4O)C)C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10289","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-didehydrocinnzeylanone
{"Ingredient_id": "HBIN003966","Ingredient_name": "2,3-didehydrocinnzeylanone","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5464","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2R)- pterosin B 14- O- β-glucopyranoside
{"Ingredient_id": "HBIN006554","Ingredient_name": "(2R)- pterosin B 14- O- \u03b2-glucopyranoside","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1CC2=CC(=C(C(=C2C1=O)C)CCOC3C(C(C(C(O3)CO)O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "35773","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-pteroside b
{"Ingredient_id": "HBIN006824","Ingredient_name": "(2s)-pteroside b","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1CC2=CC(=C(C(=C2C1=O)C)CCOC3C(C(C(C(O3)CO)O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18103","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-chloro-N-[1-methyl-5-[[1-methyl-5-[[1-methyl-5-(2-morpholinoethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]carbamoyl]pyrrol-3-yl]-5-[2-(2-pyridyl)ethylamino]isothiazole-3-carboxamide
{"Ingredient_id": "HBIN010297","Ingredient_name": "4-chloro-N-[1-methyl-5-[[1-methyl-5-[[1-methyl-5-(2-morpholinoethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]carbamoyl]pyrrol-3-yl]-5-[2-(2-pyridyl)ethylamino]isothiazole-3-carboxamide","Alias": "4-chloro-N-[1-methyl-5-[[[1-methyl-5-[[[1-methyl-5-[(2-morpholinoethylamino)-oxomethyl]-3-pyrrolyl]amino]-oxomethyl]-3-pyrrolyl]amino]-oxomethyl]-3-pyrrolyl]-5-[2-(2-pyridyl)ethylamino]-3-isothiazolecarboxamide; 4-chloro-N-[1-methyl-5-[[1-methyl-5-[[1-methyl-5-(2-morpholin-4-ylethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]carbamoyl]pyrrol-3-yl]-5-(2-pyridin-2-ylethylamino)-1,2-thiazole-3-carboxamide; 3-Isothiazolecarboxamide, 4-chloro-N-[1-methyl-5-[[[1-methyl-5-[[[1-methyl-5-[[[2-(4-morpholinyl)ethyl]amino]carbonyl]-1H-pyrrol-3-yl]amino]carbonyl]-1H-pyrrol-3-yl]amino]carbonyl]-1H-pyrrol-3-yl]-5-[[2-(2-pyridinyl)ethyl]amino]-; AIDS-111720; AIDS111720","Ingredient_formula": "C24H28O4","Ingredient_Smile": "CN1C=C(C=C1C(=O)NCCN2CCOCC2)NC(=O)C3=CC(=CN3C)NC(=O)C4=CC(=CN4C)NC(=O)C5=NSC(=C5Cl)NCCC6=CC=CC=N6","Ingredient_weight": "380.48","OB_score": "7.182423351","CAS_id": "210045-96-8","SymMap_id": "SMIT09588","TCMID_id": "NA","TCMSP_id": "MOL008278","TCM_ID_id": "NA","PubChem_id": "488866","DrugBank_id": "NA"}
4-hydroxy-1-naphthalenyl-β-d-glucopyranoside
{"Ingredient_id": "HBIN010428","Ingredient_name": "4-hydroxy-1-naphthalenyl-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1=C2CC(CCC2=CC(=C1OC3C(C(C(C(O3)CO)O)O)O)O)C(=C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10535","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6,7,3',8'-diligustilide
{"Ingredient_id": "HBIN012046","Ingredient_name": "6,7,3',8'-diligustilide","Alias": "NA","Ingredient_formula": "C24H28O4","Ingredient_Smile": "NA","Ingredient_weight": "380.48","OB_score": "9.833157604","CAS_id": "89354-45-0","SymMap_id": "SMIT06503","TCMID_id": "NA","TCMSP_id": "MOL004613","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8α-angeloxy-2α,4α,10β-trihydroxy-6βh,7αh,11βh-1(5)-guaien-12,6α-olide
{"Ingredient_id": "HBIN013621","Ingredient_name": "8\u03b1-angeloxy-2\u03b1,4\u03b1,10\u03b2-trihydroxy-6\u03b2h,7\u03b1h,11\u03b2h-1(5)-guaien-12,6\u03b1-olide","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1203","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}