Exact Mass: 470.2053
Exact Mass Matches: 470.2053
Found 500 metabolites which its exact mass value is equals to given mass value 470.2053
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Linonin
Linonin, also known as 7,16-dioxo-7,16-dideoxylimondiol or evodin, is a member of the class of compounds known as limonoids. Limonoids are highly oxygenated, modified terpenoids with a prototypical structure either containing or derived from a precursor with a 4,4,8-trimethyl-17-furanylsteroid skeleton. All naturally occurring citrus limonoids contain a furan ring attached to the D-ring, at C-17, as well as oxygen containing functional groups at C-3, C-4, C-7, C-16 and C-17. Linonin is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Linonin can be found in lemon, which makes linonin a potential biomarker for the consumption of this food product. Limonin is a limonoid, an epoxide, a hexacyclic triterpenoid, a member of furans, an organic heterohexacyclic compound and a lactone. It has a role as a metabolite, an inhibitor and a volatile oil component. Limonin is a natural product found in Citrus tankan, Flacourtia jangomas, and other organisms with data available. Limonin is a triterpenoid compound rich in citrus fruits that has antiviral and antitumor activities. Limonin is a triterpenoid compound rich in citrus fruits that has antiviral and antitumor activities.
Zapoterin
Zapoterin is found in pomes. Zapoterin is a constituent of the seeds of Casimiroa edulis (Mexican apple) Constituent of the seeds of Casimiroa edulis (Mexican apple). Zapoterin is found in pomes. (1S,3aS,4aR,4bR,6aR,11aR,11bR,12S,13aS)-1-(3-Furanyl)-1,6a,7,11a,11b,12,13,13a-octahydro-12-hydroxy-4b,7,7,11a,13a-pentamethyloxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=35796-71-5 (retrieved 2024-11-15) (CAS RN: 23885-43-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Butyrylmallotochromene
Limonin
Limonin is found in citrus. Limonin is isolated from oranges and other citrus fruits (Citrus species). Limonin is a limonoid, and a bitter, white, crystalline substance found in orange and lemon seeds. It is also known as limonoate D-ring-lactone and limonoic acid di-delta-lactone. Chemically, it is a member of the class of compounds known as furanolactones Isolated from oranges and other citrus fruits (Citrus subspecies). Limonin is a triterpenoid compound rich in citrus fruits that has antiviral and antitumor activities. Limonin is a triterpenoid compound rich in citrus fruits that has antiviral and antitumor activities.
Antiarrhythmic peptide
Benzyloxycarbonylphenylalanylphenylalanine diazomethyl ketone
Imiglitazar
Lactose-lysine
2,6-Bis(4-hydroxybenzyl-5,3-dimethoxy-3-hydroxybibenzyl
Mallotophilippen B
A chromenol that is 2H-chromene-5,7-diol substituted by geminal methyl groups at position 2, a 2-methylbutanoyl group at position 8 and a 3-acetyl-2,4,6-trihydroxy-5-methylbenzyl group at position 6. Isolated from Mallotus philippensis, it exhibits anti-inflammatory activity.
methyl (4bR,10aR,12aS)-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-10b,11-dihydronaphtho[2,1-f]isochromene-4a-carboxylate
(aS,6R,7R,8R)-5,6,7,8-tetrahydro-1,13-dihydroxy-2,3-dimethoxy-6,7-dimethyl-benzo[3,4]cycloocta[1,2:4,5]benzo[1,2-d][1,3]dioxol-8-yl (2Z)-2-methylbut-2-enoate|kadsutherin A
1,3-Diangeloyl-2-(2-methyl-butyryl)-6-ethyl-myoinositol
1L-myo-inositol 1alpha-senecioyl 2alpha-acetyl 3alpha-angeloyl 4beta-methylbutyryl 1(equatorial),5alpha,6alpha
3-[2-(3-hydroxyphenyl)ethyl]-2,6-bis[(4-hydroxyphenyl)methyl]-5-methoxyphenol|bulbocodin D
3-Sulfate -(3beta,5beta,11alpha,14beta)-3,5,14-Trihydroxycard-20(22)-enolide
10alpha-acetoxy-8alpha-O-(beta-D-glucopyranosyl)-1alphaH,5alphaH,6betaH,8betaH,7alphaH,11betaH,11alpha-methylguaia-3-enolide|amberin C
17-benzoyloxy-ajmal-19-ene-16-carboxylic acid methyl ester|O-Benzoyl-vincamajin
Limonin
Limonin is a limonoid, an epoxide, a hexacyclic triterpenoid, a member of furans, an organic heterohexacyclic compound and a lactone. It has a role as a metabolite, an inhibitor and a volatile oil component. Limonin is a natural product found in Citrus tankan, Flacourtia jangomas, and other organisms with data available. Limonin is a triterpenoid compound rich in citrus fruits that has antiviral and antitumor activities. Limonin is a triterpenoid compound rich in citrus fruits that has antiviral and antitumor activities.
(2R,3R)-4,5,5,7-tetrahydroxy-3-methoxy-6-[6-hydroxy-3,7-dimethyl-2(E),7-octadienyl]flavanone
(3S,4S)-3-O-(3,4-diangelyl-beta-D-glucopyranosyl)-dihydro-3-hydroxy-4-methyl-4-ethyl-2(3H)-furanone
methyl (2R,7S,8S)-8-[(2S)-2-(3,4-dihydroxy-2,5-dimethoxytetrahydro-3-furanyl)-2-hydroxyethyl]-2,8-dimethyl-10-oxo-11-oxatricyclo[7.2.1.0(2,7)]dodec-3-ene-3-carboxylate|rumphiol E
His Ser Val Glu
4,6-dihydroxy-3-(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy-2-pentylbenzoic acid
3,9-dihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid
C26H30O8_4aH-Phenanthro[2,1-c]pyran-4a-carboxylic acid, 1,3,4,4b,5,7,8,10a,10b,11,12,12a-dodecahydro-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,5,8-tetraoxo-, methyl ester, (4bR,10aR,12aS)
C26H30O8_3-(1-Acetoxy-3-methylbutyl)-6-{2-hydroxy-4-methyl-6-[(1E)-3-oxo-1-buten-1-yl]phenoxy}-2-methoxybenzoic acid
4,6-dihydroxy-3-(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy-2-pentylbenzoic acid [IIN-based: Match]
methyl (4bR,10aR,12aS)-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-10b,11-dihydronaphtho[2,1-f]isochromene-4a-carboxylate_major
methyl (4bR,10aR,12aS)-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-10b,11-dihydronaphtho[2,1-f]isochromene-4a-carboxylate_55.1\\%
methyl (4bR,10aR,12aS)-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-10b,11-dihydronaphtho[2,1-f]isochromene-4a-carboxylate_52.5\\%
methyl (4bR,10aR,12aS)-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-10b,11-dihydronaphtho[2,1-f]isochromene-4a-carboxylate_14.4\\%
Ala Ala Phe Tyr
Ala Ala Tyr Phe
Ala Phe Ala Tyr
Ala Phe Phe Ser
Ala Phe Ser Phe
Ala Phe Tyr Ala
Ala Met Ser Tyr
Ala Met Tyr Ser
Ala Ser Phe Phe
Ala Ser Met Tyr
Ala Ser Tyr Met
Ala Tyr Ala Phe
Ala Tyr Phe Ala
Ala Tyr Met Ser
Ala Tyr Ser Met
Cys Phe Thr Thr
Cys Ser Val Tyr
Cys Ser Tyr Val
Cys Thr Phe Thr
Asp His Ile Ser
Asp His Leu Ser
Asp His Ser Ile
Asp His Ser Leu
Asp His Thr Val
Asp His Val Thr
Asp Ile His Ser
Asp Ile Ser His
Asp Leu His Ser
Asp Leu Ser His
Asp Ser His Ile
Asp Ser His Leu
Asp Ser Ile His
Asp Ser Leu His
Asp Thr His Val
Asp Thr Val His
Asp Val His Thr
Asp Val Thr His
Glu Glu Pro Pro
Glu His Ser Val
Glu His Val Ser
Glu Pro Glu Pro
Glu Pro Pro Glu
Glu Ser His Val
Glu Ser Val His
Glu Val His Ser
Glu Val Ser His
Phe Ala Ala Tyr
Phe Ala Phe Ser
Phe Ala Ser Phe
Phe Ala Tyr Ala
Phe Phe Ala Ser
Phe Phe Gly Thr
Phe Phe Ser Ala
Phe Phe Thr Gly
Phe Gly Phe Thr
Phe Gly Thr Phe
Phe Ser Ala Phe
Phe Ser Phe Ala
Phe Thr Phe Gly
Phe Thr Gly Phe
Phe Tyr Ala Ala
Gly Phe Phe Thr
Gly Phe Thr Phe
Gly Thr Phe Phe
His Asp Ile Ser
His Asp Leu Ser
His Asp Ser Ile
His Asp Ser Leu
His Asp Thr Val
His Asp Val Thr
His Glu Ser Val
His Glu Val Ser
His Ile Asp Ser
His Ile Ser Asp
His Leu Asp Ser
His Leu Ser Asp
His Met Pro Ser
His Met Ser Pro
His Asn Asn Ser
His Asn Ser Asn
His Pro Met Ser
His Pro Ser Met
His Ser Asp Ile
His Ser Asp Leu
His Ser Glu Val
His Ser Ile Asp
His Ser Leu Asp
His Ser Met Pro
His Ser Asn Asn
His Ser Pro Met
His Thr Asp Val
His Thr Val Asp
His Val Asp Thr
His Val Glu Ser
His Val Ser Glu
His Val Thr Asp
Ile Asp His Ser
Ile Asp Ser His
Ile His Asp Ser
Ile His Ser Asp
Ile Ser Asp His
Ile Ser His Asp
Leu Asp His Ser
Leu Asp Ser His
Leu His Asp Ser
Leu His Ser Asp
Leu Ser Asp His
Leu Ser His Asp
Met Phe Ser Ser
Met His Pro Ser
Met His Ser Pro
Met Pro His Ser
Met Pro Ser His
Met Ser His Pro
Met Ser Pro His
Met Tyr Ser Ala
Asn His Asn Ser
Asn His Ser Asn
Asn Asn His Ser
Asn Asn Ser His
Asn Ser His Asn
Asn Ser Asn His
Pro Glu Glu Pro
Pro Glu Pro Glu
Pro His Met Ser
Pro His Ser Met
Pro Met His Ser
Pro Met Ser His
Pro Pro Glu Glu
Pro Ser His Met
Pro Ser Met His
Ser Ala Phe Phe
Ser Cys Tyr Val
Ser Asp His Ile
Ser Asp His Leu
Ser Asp Ile His
Ser Asp Leu His
Ser Glu His Val
Ser Glu Val His
Ser Phe Ala Phe
Ser Phe Phe Ala
Ser Phe Ser Met
Ser His Asp Ile
Ser His Asp Leu
Ser His Glu Val
Ser His Ile Asp
Ser His Leu Asp
Ser His Met Pro
Ser His Asn Asn
Ser His Pro Met
Ser His Val Glu
Ser Ile Asp His
Ser Ile His Asp
Ser Leu Asp His
Ser Leu His Asp
Ser Met Ala Tyr
Ser Met His Pro
Ser Met Pro His
Ser Met Ser Phe
Ser Met Tyr Ala
Ser Asn His Asn
Ser Asn Asn His
Ser Pro His Met
Ser Pro Met His
Ser Ser Phe Met
Ser Ser Met Phe
Ser Thr Thr Tyr
Ser Thr Tyr Thr
Ser Val Cys Tyr
Ser Val Glu His
Ser Val His Glu
Ser Val Tyr Cys
Ser Tyr Ala Met
Ser Tyr Cys Val
Ser Tyr Met Ala
Ser Tyr Thr Thr
Ser Tyr Val Cys
Thr Cys Phe Thr
Thr Cys Thr Phe
Thr Asp His Val
Thr Asp Val His
Thr Phe Cys Thr
Thr Phe Phe Gly
Thr Phe Gly Phe
Thr Phe Thr Cys
Thr Gly Phe Phe
Thr Gly Met Tyr
Thr Gly Tyr Met
Thr His Asp Val
Thr His Val Asp
Thr Met Gly Tyr
Thr Met Tyr Gly
Thr Ser Thr Tyr
Thr Ser Tyr Thr
Thr Thr Cys Phe
Thr Thr Phe Cys
Thr Thr Ser Tyr
Thr Thr Tyr Ser
Thr Val Asp His
Thr Val His Asp
Thr Tyr Gly Met
Thr Tyr Met Gly
Thr Tyr Ser Thr
Thr Tyr Thr Ser
Val Cys Ser Tyr
Val Cys Tyr Ser
Val Asp His Thr
Val Asp Thr His
Val Glu His Ser
Val Glu Ser His
Val His Asp Thr
Val His Glu Ser
Val His Ser Glu
Val His Thr Asp
Val Ser Cys Tyr
Val Ser Glu His
Val Ser His Glu
Val Ser Tyr Cys
Val Thr Asp His
Val Thr His Asp
Val Tyr Cys Ser
Val Tyr Ser Cys
Tyr Ala Ala Phe
Tyr Ala Phe Ala
Tyr Ala Met Ser
Tyr Ala Ser Met
Tyr Cys Ser Val
Tyr Cys Val Ser
Tyr Phe Ala Ala
Tyr Gly Met Thr
Tyr Gly Thr Met
Tyr Met Ala Ser
Tyr Met Gly Thr
Tyr Met Ser Ala
Tyr Met Thr Gly
Tyr Ser Ala Met
Tyr Ser Cys Val
Tyr Ser Met Ala
Tyr Ser Thr Thr
Tyr Ser Val Cys
Tyr Thr Gly Met
Tyr Thr Met Gly
Tyr Thr Ser Thr
Tyr Thr Thr Ser
Tyr Val Cys Ser
Tyr Val Ser Cys
4-tert-butylphenol,2-(chloromethyl)oxirane,4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
Moexiprilat
C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor
N-(3-Amino-3-oxopropyl)-2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-N-(2-pyridinyl)-1H-benzimidazole-5-carboxamide
(S)-2-((S)-2-(((R)-1-Carboxy-3-phenylpropyl)amino)propanoyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
1-N,4-N-bis(3,5-dimethoxyphenyl)-3,6-dimethyl-1,2,4,5-tetrazine-1,4-dicarboxamide
methyl (2Z,5Z)-7-[(2R)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hepta-2,5-dienoate
(2R)-1,1,1-Trifluoro-4-[2-methoxy-5-(5-pyrimidinyl)phenyl]-4-meth yl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)-2-pentanol
2-(4-Diphenylmethyl-1-piperazinyl)ethyl Acetoacetate Oxalate
Imiglitazar
C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C154291 - Peroxisome Proliferator-Activated Receptor Agonist
Cormethasone acetate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
116964-16-0
(E)-4-[4-(5-methyl-2-phenyl-4-oxazolylmethoxy)benzyloxyimino]-4-phenylbutyric acid
3-[[[1-(2-furanylmethyl)-5-tetrazolyl]methyl-[(2-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-2-one
4-[[3-[2-(1-cyclohexenyl)ethyl]-4-oxo-2-sulfanylidene-1H-quinazolin-7-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester
[4-[(2-Chlorophenyl)methyl]-1-piperazinyl]-(6,8-dimethyl-2-pyridin-4-yl-4-quinolinyl)methanone
2-[(1,3-dimethyl-2,6-dioxo-7-propyl-8-purinyl)thio]-N-[2-(1-piperidinyl)phenyl]acetamide
6-ethoxy-3-[[2-furanylmethyl-[[1-(phenylmethyl)-5-tetrazolyl]methyl]amino]methyl]-1H-quinolin-2-one
1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
Ethyl 7-benzyl-1-[(4-fluorophenyl)methyl]-5-phenyl-4,6-dihydrotriazolo[4,5-c]pyridine-7-carboxylate
1-[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-8-(methanesulfonamido)-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-propan-2-ylurea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea
1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea
1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
N-[(2R,4aR,12aR)-5-methyl-6-oxo-2-[2-oxo-2-(propylamino)ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
(6S,7S,8S)-4-[1,3-benzodioxol-5-yl(oxo)methyl]-8-(hydroxymethyl)-7-[4-(3-methylphenyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
1-(1,3-benzodioxol-5-yl)-3-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-8-(methanesulfonamido)-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-propan-2-ylurea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea
1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
(2R)-2-[(4S,5S)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-8-(2-phenylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
[(3aR,4S,9bS)-4-(hydroxymethyl)-8-[2-(3-methoxyphenyl)ethynyl]-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-(2-fluorophenyl)methanone
(3S)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxylic acid
(1R)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1S)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(6R,7R,8S)-4-[1,3-benzodioxol-5-yl(oxo)methyl]-8-(hydroxymethyl)-7-[4-(3-methylphenyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8R)-4-[1,3-benzodioxol-5-yl(oxo)methyl]-8-(hydroxymethyl)-7-[4-(3-methylphenyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(2S,3S,4S,5R)-6-[1-[[3,5-bis(2-cyanopropan-2-yl)phenyl]methyl]-1,2,4-triazol-4-ium-4-yl]-3,4,5-trihydroxyoxane-2-carboxylic acid
(1-acetyloxy-3-phosphonooxypropan-2-yl) (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate
(1s,2r,4s,7s,8s,11r,12s,18r,20r)-7-(furan-3-yl)-20-hydroxy-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-ene-5,10,15-trione
methyl (2s,4as,10as,10br)-6-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-2h,10bh,11h-phenanthro[1,2-c]pyran-4a-carboxylate
methyl 6-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-2h,10bh,11h-phenanthro[1,2-c]pyran-4a-carboxylate
(2r,3s)-10-[(2s)-2,3-dihydroxy-3-methylbutyl]-3,5-dihydroxy-2-(4-methoxyphenyl)-8,8-dimethyl-2h,3h-pyrano[3,2-g]chromen-4-one
18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-trien-3-yl 2-methylbutanoate
(1s,2r,7s,10r,13r,14r,16s,19s,20s)-19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.0²,⁷.0²,¹⁰.0¹⁴,¹⁶.0¹⁴,²⁰]docosane-5,12,17-trione
(2z)-1-[(8s,9r,10r)-3,9-dihydroxy-4,5,19-trimethoxy-10-methyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2,4,6,13,18-hexaen-8-yl]-2-methylbut-2-en-1-one
(1r,3s,6s,7s,11s)-6-(furan-3-yl)-11-[(1s,3r,5r)-1-hydroxy-1,6,6-trimethyl-8-oxo-2,7-dioxaspiro[4.5]dec-9-en-3-yl]-7,11-dimethyl-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-4-one
11-{3a-acetyl-4,4-dimethyl-6-oxo-tetrahydrofuro[3,2-c]pyran-2-yl}-6-(furan-3-yl)-7,11-dimethyl-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-4-one
(1r,3s,6s,7s,11s)-6-(furan-3-yl)-11-[(1s,3s,5r)-1-hydroxy-1,6,6-trimethyl-8-oxo-2,7-dioxaspiro[4.5]dec-9-en-3-yl]-7,11-dimethyl-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-4-one
[(1z,4s,5s,6r,7e,9e,11e)-6-hydroxy-1-[(2r,3s)-3-hydroxy-6-oxo-2,3-dihydropyran-2-yl]-5-methylheptadeca-1,7,9,11-tetraen-4-yl]oxysulfonic acid
2-[(4-ethyl-4-methyl-2-oxooxolan-3-yl)oxy]-3-hydroxy-6-(hydroxymethyl)-5-[(2-methylbut-2-enoyl)oxy]oxan-4-yl 2-methylbut-2-enoate
(2s)-2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-6-[(2e,6r)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]-2,3-dihydro-1-benzopyran-4-one
(2r,3r)-10-[(2s)-2,3-dihydroxy-3-methylbutyl]-3,5-dihydroxy-2-(4-methoxyphenyl)-8,8-dimethyl-2h,3h-pyrano[3,2-g]chromen-4-one
(1s,2s,5s,6s,7r,8s,9r,12r)-5,7,8-tris(acetyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl acetate
6-(furan-3-yl)-13,14-dihydroxy-5,12,16,16-tetramethyl-7,10,17-trioxahexacyclo[13.3.3.0¹,¹⁵.0²,¹².0⁵,¹¹.0⁹,¹¹]henicos-19-ene-8,21-dione
(1r,2r,7s,10r,13r,14r,16s,19r,20s)-19-(furan-2-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.0²,⁷.0²,¹⁰.0¹⁴,¹⁶.0¹⁴,²⁰]docosane-5,12,17-trione
11-oxo-7α-obacunol
{"Ingredient_id": "HBIN000498","Ingredient_name": "11-oxo-7\u03b1-obacunol","Alias": "NA","Ingredient_formula": "C26H30O8","Ingredient_Smile": "CC1(C2CC(C3(C(C2(C=CC(=O)O1)C)C(=O)CC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16386","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,6-bis(p-hydroxybenzyl)-3',5-dimethoxy-3-hydroxybibenzyl
{"Ingredient_id": "HBIN004865","Ingredient_name": "2,6-bis(p-hydroxybenzyl)-3',5-dimethoxy-3-hydroxybibenzyl","Alias": "NA","Ingredient_formula": "C30H30O5","Ingredient_Smile": "COC1=CC=CC(=C1)CCC2=C(C(=CC(=C2CC3=CC=C(C=C3)O)OC)O)CC4=CC=C(C=C4)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2457","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}