Exact Mass: 430.1856228
Exact Mass Matches: 430.1856228
Found 500 metabolites which its exact mass value is equals to given mass value 430.1856228
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
ATHAMANTIN
Avizafone
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
2,2-Dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate
Phenethyl rutinoside
Phenethyl rutinoside is found in citrus. Phenethyl rutinoside is isolated from Citrus unshiu (Satsuma mandarin Isolated from Citrus unshiu (Satsuma mandarin). Phenethyl rutinoside is found in citrus and pomegranate.
Armillarilin
Armillarilin is found in mushrooms. Armillarilin is a metabolite of Armillaria mellea (honey mushroom Metabolite of Armillaria mellea (honey mushroom). Armillarilin is found in mushrooms.
Melleolide H
Melleolide H is found in mushrooms. Melleolide H is a metabolite of Armillariella mellea (honey mushroom). Metabolite of Armillariella mellea (honey mushroom). Melleolide H is found in mushrooms.
Mammea E/BA
Mammea E/BA is found in fruits. Mammea E/BA is isolated from seeds of Mammea americana (mamey
Mammea E/BB
Mammea E/BB is found in fruits. Mammea E/BB is isolated from seeds of Mammea americana (mamey
Hypophyllanthin
(3-{[3-(2-Amino-2-Oxoethyl)-1-Benzyl-2-Ethyl-1h-Indol-5-Yl]oxy}propyl)phosphonic Acid
C22H27N2O5P (430.16575020000005)
LY-311727 is a potent secretory non-pancreatic phospholipase A2 (sPLA2) inhibitor (IC50 <1 μM for group IIA sPLA2). sPLA2 is an important proinflammatory enzyme[1][2].
Nirtetralin
beta-Phenylethanol beta-D-rutinoside
Beta-phenylethanol beta-d-rutinoside is a member of the class of compounds known as O-glycosyl compounds. O-glycosyl compounds are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. Beta-phenylethanol beta-d-rutinoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Beta-phenylethanol beta-d-rutinoside can be found in common grape, which makes beta-phenylethanol beta-d-rutinoside a potential biomarker for the consumption of this food product.
Hypophyllantin
Hypophyllanthin is a natural product found in Phyllanthus niruri and Phyllanthus urinaria with data available. See also: Phyllanthus amarus top (part of). Hypophyllanthin is a major lignan in Phyllanthus spp, with strong anti-inflammatory activity. Hypophyllanthin directly inhibits P-glycoprotein (P-gp) activity and did not interfere with multidrug resistance protein 2 (MRP2) activity[1][2].
Kadsulignan N
kadsulignan N is a natural product found in Kadsura japonica, Kadsura angustifolia, and Kadsura coccinea with data available.
(7S,8R,1S,2S,3R)-Delta8-2-acetoxy-3,5,3,4-tetramethoxy-1,2,3,4-tetrahydro-7.3,8.1-neolignan
8-O-(2,6-Diacetyl-beta-D-glucopyranoside)-(2E,4xi)-4,8-Dihydroxy-2-methyl-6-methylene-2-octenal
2-(2,4-Dihydroxy-6-pentyl-phenoxy)-4-methoxy-6-valeryl-benzoesaeure|2-(2,4-dihydroxy-6-pentyl-phenoxy)-4-methoxy-6-valeryl-benzoic acid|4.6-Dioxy-5-methoxy-2-n-amyl-3-n-valeryl-diphenylaether-carbonsaeure-(2)|4-Methoxy-6-(4.6-dihydroxy-2-pentyl-phenoxy)-2-valeryl-benzoesaeure|4-Methoxy-6-(4.6-dioxy-2-n-amyl-phenoxyl)-2-n-valeryl-benzoesaeure|Lobariol
dihydrocinnamyl alcohol 9-O-(6-O-alpha-L-arabinofuranosyl)-beta-D-glucopyranoside|junipercomnoside F
2alpha,13alpha-diacetoxy-10beta-hydroxy-2(3->20)-abeo-taxa-4(20),6,11-triene-5,9-dione
3alpha-senecioyloxy-6beta-methacryloyloxyivangustin
(1R,2R,4R)-4-<2-acetoxy-2-(3,4-dimethoxyphenyl)-1-methylethyl>-4,5-dimethoxy-2-(2-propenyl)cyclohexa-2,5-dien-1-one|(1R,2R,4R)-4-[2-acetoxy-2-(3,4-dimethoxyphenyl)-1-methylethyl]-4,5-dimethoxy-2-(2-propenyl)cyclohexa-2,5-dien-1-one
6beta-angeloyloxy-9beta-isobutyryloxy-8-epizinamultifluoride
rel-(1R,4R,5R,7R,8S)-Delta2,8-4-acetoxy-3,4,3,5-tetramethoxy-6-oxo-8.1,7.5-neolignan
2-phenylethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
nirtetralin
CID 13989913 is a natural product found in Phyllanthus niruri and Phyllanthus urinaria with data available.
theiferin|threo-(7R,8R)-7-acetoxy-3,4-dimethoxy-3,4-dimethoxy-Delta-8-8.O.6-neolignan
1alpha,6alpha-diacetoxy-5alpha,7beta-dihydroxy-14-methylvoucapane-8(14),9(11)-diene|caesalpin E
Odonicin
5alpha-hydroxy-1alpha,2alpha-diacetoxycass-8,11,13(15)-trien-16,12-olide|neocaesalpin AD
[8,8-dimethyl-9-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbutanoate
Thiobiscephalosporolide A|thiobiscephalosporolide-A
1beta,7beta-diacetoxy-8beta,14beta-epoxy-ent-abieta-2(3),13(14)-dien-16,12-olide|gelomulide M
(-)-2beta-(3-methyl-1xi,2xi,3-trihydroxybutyl)-2-deoxybruceol
1,2,3,5,13-Pentamethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3,4]cycloocta[1,2-f][1,3]benzodioxole
1L-myo-inositol 1alpha,2alpha-diacetyl 3alpha-angaloyl 4beta-methylbutyryl 1(equatorial),5alpha,6beta
(3S,4S,5R)--5-[(3Z)-4,8-dimethylnona-3,7-dien-1-yl]-4,5-dihydro-4,8-dihydroxy-5-methyl-3H,5H-spiro[1,4-benzodioxepine-3,2-furan]-2,5-dione|ferulactone B
(2R,3S,5aS,9R,10S,12aR,12bR)-2,3,5a,6,9,10,12a,12b-octahydro-7,12a-dihydroxy-12b-methoxy-2,3,4,9,10,11-hexamethyl-5H-difuro[2,3-b:2,3-h]xanthen-5-one|penidicitrinin A
(3Z)-hexenyl-O-beta-D-tetraacetylglucopyranoside|(Z)-3-hexenyl-(tetra-O-acetyl)-beta-D-glucopyranoside
3-O-acetyl-14-O-benzoylminwanensin|rel-(4R,5S,6S,6aR,7S,9R,9aR)-7-(acetyloxy)-6-[(benzoyloxy)methyl]-hexahydro-6a-hydroxy-5,6,9-trimethyl-4H-4,9a-methanocyclopent[d]oxocin-2(1H)-one
[1-(3,4-dimethoxyphenyl)-2-(2,6-dimethoxy-4-prop-2-enylphenoxy)propyl] acetate
[(9R,10R)-8,8-dimethyl-9-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbutanoate
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate
C24H30O7_Benzoic acid, 4-hydroxy-, 1-(acetyloxy)-1,2,3,3a,4,7,8,8a-octahydro-3-hydroxy-6,8a-dimethyl-3-(1-methylethyl)-7-oxo-4-azulenyl ester
C20H30O10_2-Phenylethyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate
(1-acetyloxy-3-hydroxy-6,8a-dimethyl-7-oxo-3-propan-2-yl-2,3a,4,8-tetrahydro-1H-azulen-4-yl) 4-hydroxybenzoate
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate [IIN-based: Match]
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate [IIN-based on: CCMSLIB00000848207]
[(9R,10R)-8,8-dimethyl-9-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbutanoate [IIN-based on: CCMSLIB00000847960]
[(9R,10R)-8,8-dimethyl-9-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbutanoate [IIN-based: Match]
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate_major
(1-acetyloxy-3-hydroxy-6,8a-dimethyl-7-oxo-3-propan-2-yl-2,3a,4,8-tetrahydro-1H-azulen-4-yl) 4-hydroxybenzoate_major
Ala Asp Glu Pro
C17H26N4O9 (430.16997060000006)
Ala Asp Pro Glu
C17H26N4O9 (430.16997060000006)
Ala Glu Asp Pro
C17H26N4O9 (430.16997060000006)
Ala Glu Pro Asp
C17H26N4O9 (430.16997060000006)
Ala Phe Gly His
Ala Phe His Gly
Ala Gly Phe His
Ala Gly His Phe
Ala His Phe Gly
Ala His Gly Phe
Ala Pro Asp Glu
C17H26N4O9 (430.16997060000006)
Ala Pro Glu Asp
C17H26N4O9 (430.16997060000006)
Asp Ala Glu Pro
C17H26N4O9 (430.16997060000006)
Asp Ala Pro Glu
C17H26N4O9 (430.16997060000006)
Asp Glu Ala Pro
C17H26N4O9 (430.16997060000006)
Asp Glu Pro Ala
C17H26N4O9 (430.16997060000006)
Asp Ile Pro Ser
Asp Ile Ser Pro
Asp Leu Pro Ser
Asp Leu Ser Pro
Asp Pro Ala Glu
C17H26N4O9 (430.16997060000006)
Asp Pro Glu Ala
C17H26N4O9 (430.16997060000006)
Asp Pro Ile Ser
Asp Pro Leu Ser
Asp Pro Ser Ile
Asp Pro Ser Leu
Asp Pro Thr Val
Asp Pro Val Thr
Asp Ser Ile Pro
Asp Ser Leu Pro
Asp Ser Pro Ile
Asp Ser Pro Leu
Asp Thr Pro Val
Asp Thr Val Pro
Asp Val Pro Thr
Asp Val Thr Pro
Glu Ala Asp Pro
C17H26N4O9 (430.16997060000006)
Glu Ala Pro Asp
C17H26N4O9 (430.16997060000006)
Glu Asp Ala Pro
C17H26N4O9 (430.16997060000006)
Glu Asp Pro Ala
C17H26N4O9 (430.16997060000006)
Glu Glu Gly Pro
C17H26N4O9 (430.16997060000006)
Glu Glu Pro Gly
C17H26N4O9 (430.16997060000006)
Glu Gly Glu Pro
C17H26N4O9 (430.16997060000006)
Glu Gly Pro Glu
C17H26N4O9 (430.16997060000006)
Glu Pro Ala Asp
C17H26N4O9 (430.16997060000006)
Glu Pro Asp Ala
C17H26N4O9 (430.16997060000006)
Glu Pro Glu Gly
C17H26N4O9 (430.16997060000006)
Glu Pro Gly Glu
C17H26N4O9 (430.16997060000006)
Glu Pro Ser Val
Glu Pro Val Ser
Glu Ser Pro Val
Glu Ser Val Pro
Phe Ala Gly His
Phe Ala His Gly
Phe Gly Ala His
Phe Gly His Ala
Phe His Ala Gly
Phe His Gly Ala
Gly Ala Phe His
Gly Ala His Phe
Gly Glu Glu Pro
C17H26N4O9 (430.16997060000006)
Gly Glu Pro Glu
C17H26N4O9 (430.16997060000006)
Gly Phe Ala His
Gly Phe His Ala
Gly His Ala Phe
Gly His Phe Ala
Gly Pro Glu Glu
C17H26N4O9 (430.16997060000006)
His Ala Phe Gly
His Ala Gly Phe
His Phe Ala Gly
His Phe Gly Ala
His Gly Ala Phe
His Gly Phe Ala
His Ser Ser Thr
His Ser Thr Ser
His Thr Ser Ser
Met Pro Pro Ser
Met Pro Ser Pro
Met Ser Pro Pro
Asn Asn Pro Ser
Asn Asn Ser Pro
Asn Pro Asn Ser
Asn Pro Ser Asn
Asn Ser Asn Pro
Asn Ser Pro Asn
Pro Ala Asp Glu
C17H26N4O9 (430.16997060000006)
Pro Ala Glu Asp
C17H26N4O9 (430.16997060000006)
Pro Asp Ala Glu
C17H26N4O9 (430.16997060000006)
Pro Asp Glu Ala
C17H26N4O9 (430.16997060000006)
Pro Glu Ala Asp
C17H26N4O9 (430.16997060000006)
Pro Glu Asp Ala
C17H26N4O9 (430.16997060000006)
Pro Glu Glu Gly
C17H26N4O9 (430.16997060000006)
Pro Glu Gly Glu
C17H26N4O9 (430.16997060000006)
Pro Gly Glu Glu
C17H26N4O9 (430.16997060000006)
Pro Met Pro Ser
Pro Met Ser Pro
Pro Asn Asn Ser
Pro Asn Ser Asn
Pro Pro Met Ser
Pro Pro Ser Met
Pro Ser Met Pro
Pro Ser Asn Asn
Pro Ser Pro Met
Ser His Ser Thr
Ser His Thr Ser
Ser Met Pro Pro
Ser Asn Asn Pro
Ser Asn Pro Asn
Ser Pro Met Pro
Ser Pro Asn Asn
Ser Pro Pro Met
Ser Ser His Thr
Ser Ser Thr His
Ser Thr His Ser
Ser Thr Ser His
Thr His Ser Ser
Thr Ser His Ser
Thr Ser Ser His
Mammea E/BB
A natural product found in Mammea americana.
Mammea E/BA
Armillarilin
Cetyl glycol
Armillarigin
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)propyl acetate
1-Acetoxy-3-hydroxy-3-isopropyl-6,8a-dimethyl-7-oxo-1,2,3,3a,4,7,8,8a-octahydro-4-azulenyl 4-hydroxybenzoate
Ptilosteroid B
C21H34O7S (430.20251340000004)
Ptilosteroid C
C21H34O7S (430.20251340000004)
ST 24:6;O7
4-(4-dimethylaminophenyl)-3-methyl-1-phenylindeno[2,1-e]pyrazolo[3,4-b]pyridine-5(1H)-one
nalpha-(tert-butoxycarbonyl)-l-arginine 4-nitroanilide hydrochloride
N,N-Bis(4-ethoxycarbonylphenyl)-N-benzylformamidine
C26H26N2O4 (430.18924760000004)
4-Piperidinecarboxamide,4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]-N,N-dimethyl-
Zinc Undecylenate
D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent
butane-1,4-diol,dimethyl benzene-1,4-dicarboxylate,hexanedioic acid
Coumarin 545T
C26H26N2O2S (430.17148960000003)
3-(S)-(+)-(1-Carbamoyl-1,1-diphenylmethyl)pyrroloidine-L-(+)-tartarate
2-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]azo]-6-methoxy-3-methylbenzothiazolium acetate
C21H26N4O4S (430.16746760000007)
Zinc,bis(2,2,6,6-tetramethyl-3,5-heptanedionato-kO3,kO5)-, (T-4)-
LY310762
LY310762 is a selective 5-HT1D receptor antagonist (Ki=249 nM) with a weak affinity for 5-HT1B receptor. LY310762 effectively abolishes the renal vasodilatory effects of 5-HTSumatriptan (HY-B0121B)-induced decrease in excitatory postsynaptic potential (EPSC) amplitude[1][2][3].
(2S,5R)-5-[(benzyloxy)amino]piperidine -2-carboxylic acid benzyl ester ethanedioate
trimethyl-[1-(2-trimethylsilyloxynaphthalen-1-yl)naphthalen-2-yl]oxysilane
C26H30O2Si2 (430.17842399999995)
2-(chloromethyl)oxirane,4-[2-(4-hydroxyphenyl)propan-2-yl]phenol,2-propan-2-yl-1H-imidazole
C24H31ClN2O3 (430.20230860000004)
decyl isopentyl sulfosuccinate sodium salt
C19H35NaO7S (430.20010800000006)
2-Amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-1-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
5,5,7,7-Tetramethyl-2-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylic acid methyl ester
C23H30N2O4S (430.19261800000004)
6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-3-(4-ethoxyphenyl)-7-triazolo[4,5-d]pyrimidinone
C23H22N6O3 (430.17533019999996)
[(9R,10R)-8,8-dimethyl-9-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbutanoate
N-(2-Methoxyethyl)-4-({4-[2-methyl-1-(1-methylethyl)-1H-imidazol-5-YL]pyrimidin-2-YL}amino)benzenesulfonamide
C20H26N6O3S (430.17870060000007)
1,2-Hydro-1-oxy-3,4-hydro-3-(1-methoxy-2-oxy-3,4-dihydroxypentyl)-8,9-dihydroxy-7-(sec-butyl)-anthracene
(1S,2R)-2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)propyl acetate
Gelomulide M
An abietane diterpenoid that is ent-abieta-2(3),13(15)-diene-16,12-olide substituted by beta-acetoxy groups at positions 1 and 7 and a beta-epoxy group across positions 8 and 14. Isolated from the leaves of Gelonium aequoreum, it exhibits moderate cytotoxicity against lung (A549), breast (MDAMB-231 and MCF7), and liver (HepG2) cancer cell lines.
Asn-Asn-Pro-Ser
A tetrapeptide composed of two L-asparagine units, L-proline and L-serine joined in sequence by peptide linkages.
8-[4-(3-Chlorophenyl)-1-piperazinyl]-3-methyl-7-pentylpurine-2,6-dione
5-[(1,3-benzodioxol-5-ylmethylamino)methyl]-3-tert-butyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one
[(1S)-1-[5,7-dihydroxy-8-[(2S)-2-methylbutanoyl]-6-(3-methylbut-2-enyl)-2-oxochromen-4-yl]propyl] acetate
N-[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-N-(2-oxolanylmethyl)cyclohexanecarboxamide
C23H30N2O4S (430.19261800000004)
N-[2-[(2R,5S,6R)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
N-[2-[(2R,5R,6R)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
N-[2-[(2S,5R,6R)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
3-fluoro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C23H27ClN2O4 (430.16592520000006)
2-[(1R,3S,4aS,9aR)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C23H27ClN2O4 (430.16592520000006)
1-[(1S,2aS,8bS)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone
1-[(1S,2aR,8bR)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone
(1S,9R,10R,11R)-12-ethyl-10-(hydroxymethyl)-6-oxo-N-phenyl-5-pyridin-4-yl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(6S,7S,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8S)-7-[4-(2-cyclohexylethynyl)phenyl]-4-ethylsulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C23H30N2O4S (430.19261800000004)
[(2S,3R)-2-(hydroxymethyl)-1-[(2-methoxyphenyl)methyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-(2-pyrazinyl)methanone
N-[2-[(2S,5R,6S)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
N-[2-[(2S,5S,6S)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
N-[2-[(2R,5R,6S)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
N-[2-[(2S,5S,6R)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
N-[2-[(2R,5S,6S)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide
3-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxanyl]benzamide
2-[(1R,3R,4aS,9aR)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C23H27ClN2O4 (430.16592520000006)
2-[(1S,3S,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C23H27ClN2O4 (430.16592520000006)
2-[(1S,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C23H27ClN2O4 (430.16592520000006)
1-[(1R,2aR,8bR)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone
1-[(1R,2aS,8bS)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone
(1R,9S,10S,11S)-12-ethyl-10-(hydroxymethyl)-6-oxo-N-phenyl-5-pyridin-4-yl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(6R,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7R,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8R)-7-[4-(2-cyclohexylethynyl)phenyl]-4-ethylsulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C23H30N2O4S (430.19261800000004)
(6R,7R,8R)-7-[4-(2-cyclohexylethynyl)phenyl]-4-ethylsulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C23H30N2O4S (430.19261800000004)
(6R,7S,8S)-7-[4-(2-cyclohexylethynyl)phenyl]-4-ethylsulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C23H30N2O4S (430.19261800000004)
(6R,7S,8R)-7-[4-(2-cyclohexylethynyl)phenyl]-4-ethylsulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C23H30N2O4S (430.19261800000004)
(1S,5R)-3-(2-methylphenyl)sulfonyl-7-[4-[(E)-2-phenylethenyl]phenyl]-3,6-diazabicyclo[3.1.1]heptane
C26H26N2O2S (430.17148960000003)
N-[(Z)-3-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]-1-[(4-methylpyrimidin-2-yl)amino]-3-oxoprop-1-en-2-yl]benzamide
C23H22N6O3 (430.17533019999996)
2-Chloro-4-[[7-methoxy-6-[3-[methyl(propyl)amino]propoxy]quinazolin-4-yl]amino]phenol
BisMePA(15:4)
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ALDH1A2-IN-1
C21H26N4O4S (430.16746760000007)
ALDH1A2-IN-1 is an active site-directed reversible ALDH1A2 inhibitor (IC50=0.91 μM; Kd=0.26 μM) with several hydrophobic interactions[1].
(2r,2as,4ar,7ar,7br)-3-formyl-4a-hydroxy-2a-methoxy-6,6,7b-trimethyl-1h,2h,5h,7h,7ah-cyclobuta[e]inden-2-yl 2,4-dihydroxy-6-methylbenzoate
4-hydroxy-5-[(4-hydroxy-10-methyl-2,7-dioxooxecan-5-yl)sulfanyl]-10-methyloxecane-2,7-dione
3,6,9-trimethyl-4-[(2-methylpropanoyl)oxy]-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-3-yl (2e)-2-methylbut-2-enoate
[(1r,2s,3as,3br,5ar,6r,7r,8s,9ar,9bs,11as)-1-ethenyl-2,6,7-trihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid
C21H34O7S (430.20251340000004)
(12r,15s,16s,17r)-11,11,15-trimethyl-16-[(1r,2r)-1,2,3-trihydroxy-3-methylbutyl]-6,10,19-trioxapentacyclo[13.3.1.0²,⁷.0⁹,¹⁸.0¹²,¹⁷]nonadeca-1,3,7,9(18)-tetraen-5-one
5'-(4,8-dimethylnona-3,7-dien-1-yl)-4',8-dihydroxy-5'-methylspiro[1,4-benzodioxepine-3,2'-oxolane]-2,5-dione
(5r,6s,7r)-5-(3,4-dimethoxyphenyl)-4-methoxy-6,7-bis(methoxymethyl)-2h,5h,6h,7h,8h-naphtho[2,3-d][1,3]dioxole
7'-hydroxy-2,9'a-dimethyl-1'-oxo-3-(6-oxopyran-3-yl)-octahydro-3'ah-spiro[cyclopentane-1,3'-naphtho[1,2-c]furan]-2-carboxylic acid
(5s,6r,7r)-5-(3,4-dimethoxyphenyl)-4-methoxy-6,7-bis(methoxymethyl)-2h,5h,6h,7h,8h-naphtho[2,3-d][1,3]dioxole
7-(3,4-dimethoxyphenyl)-1,3-dimethoxy-6-methyl-8-oxo-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-en-2-yl acetate
2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-(2-phenylethoxy)oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol
4,9-dimethyl-14-methylidene-8-[(2-methylprop-2-enoyl)oxy]-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-2-yl 2-methylbut-2-enoate
[5-(acetyloxy)-3,4-dihydroxy-6-[(5-hydroxy-7-methyl-3-methylidene-8-oxooct-6-en-1-yl)oxy]oxan-2-yl]methyl acetate
12-(acetyloxy)-5,11,15,15-tetramethyl-6-oxo-2,7-dioxapentacyclo[8.8.0.0¹,³.0⁴,⁸.0¹¹,¹⁶]octadeca-4,13-dien-18-yl acetate
(1s,2r,6s,7r,9r)-9-hydroxy-4,6-bis(4-hydroxyphenyl)-11-isopropyl-9-methyltricyclo[5.2.2.0²,⁶]undeca-4,10-diene-3,8-dione
[2-(acetyloxy)-7-ethenyl-4b,10-dihydroxy-1,7-dimethyl-9-oxo-2h,3h,3ah,4h,5h,6h-cyclopropa[f]phenanthren-1-yl]methyl acetate
(2s,3r,4e)-5-{2-[({2-[(1e,3r,4s)-3,4-dihydroxypent-1-en-1-yl]-6-hydroxyphenyl}methoxy)methyl]-3-hydroxyphenyl}pent-4-ene-2,3-diol
(1r,15r,18r)-4,5,6,9,10,11-hexamethoxy-18-methyl-17-oxatetracyclo[13.2.1.0²,⁷.0⁸,¹³]octadeca-2(7),3,5,8(13),9,11-hexaene
(2r,4ar,4bs,10as,10bs,12ar)-6,10b-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-2h,4ah,9h,10h,11h-phenanthro[1,2-c]pyran-1,4,5,8-tetrone
(1s,2r,3r,4s,5s,6r)-2,3-bis(acetyloxy)-4,5-dihydroxy-6-[(3-methylbutanoyl)oxy]cyclohexyl (2z)-2-methylbut-2-enoate
[(4as,4br,7r,8ar,10s,10ar)-10-(acetyloxy)-1,1-dimethyl-4,9-dioxo-7-(3-oxoprop-1-en-2-yl)-4b,5,6,7,8,8a,10,10a-octahydrophenanthren-4a-yl]methyl acetate
(2s,3r,4e)-5-[2-({2-[(1e,3r,4s)-3,4-dihydroxypent-1-en-1-yl]-4-hydroxy-3-(hydroxymethyl)phenyl}methyl)-3-hydroxyphenyl]pent-4-ene-2,3-diol
(1r,2r)-2-[4,5-dimethoxy-2-(prop-2-en-1-yl)phenoxy]-1-(3,4-dimethoxyphenyl)propyl acetate
2-{9-[(3-methylbutanoyl)oxy]-2-oxo-8h,9h-furo[2,3-h]chromen-8-yl}propan-2-yl 3-methylbutanoate
3-{[(3ar,4r,11ar)-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl]oxy}-2-methylidene-3-oxopropyl (2z)-2-(hydroxymethyl)but-2-enoate
andrographolide-3-o-sulfate
{"Ingredient_id": "HBIN016022","Ingredient_name": "andrographolide-3-o-sulfate","Alias": "NA","Ingredient_formula": "C20H30O8S","Ingredient_Smile": "CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)OS(=O)(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1160","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,9r,15s,16s,17s,18r,21r)-15,17,18-trihydroxy-18-(methoxycarbonyl)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-2-carboxylic acid
(1s,2s,5r,7s,8s,9s,10s,11r)-10-(acetyloxy)-9-hydroxy-12,12-dimethyl-6-methylidene-15-oxo-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadec-13-en-7-yl acetate
(3as,4r,9as)-5,6,7-trimethoxy-4-(3,4,5-trimethoxyphenyl)-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan
methyl 11,15-dihydroxy-2,6,6,11,14-pentamethyl-17-methylidene-8,16-dioxo-7-oxatetracyclo[12.2.1.0²,¹².0⁵,¹⁰]heptadeca-4,9-diene-1-carboxylate
(3as,5r,5ar,6r,9r,9ar,9bs)-6-[(acetyloxy)methyl]-9-hydroxy-6,9a-dimethyl-3-oxo-octahydro-1h-naphtho[1,2-c]furan-5-yl benzoate
(3s,3ar,4r,9ar,9bs)-3,6,9-trimethyl-4-[(2-methylpropanoyl)oxy]-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-3-yl (2z)-2-methylbut-2-enoate
3-formyl-4a-hydroxy-2a-methoxy-6,6,7b-trimethyl-1h,2h,5h,7h,7ah-cyclobuta[e]inden-2-yl 2,4-dihydroxy-6-methylbenzoate
6,10b-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-2h,4ah,9h,10h,11h-phenanthro[1,2-c]pyran-1,4,5,8-tetrone
(1r,14s,15s,16r)-4,5,6,9,10,11-hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.0²,⁷.0⁸,¹³]heptadeca-2(7),3,5,8(13),9,11-hexaene
(3r,4r,6r,7s,11s,17r,18s)-3,14-dihydroxy-4-methoxy-6,7,9,17,18,20-hexamethyl-2,5,16-trioxapentacyclo[11.7.0.0³,¹¹.0⁴,⁸.0¹⁵,¹⁹]icosa-1(20),8,13,15(19)-tetraen-10-one
(2s,3r,4e)-5-[3-hydroxy-2-({[(1e,3r,4s)-4-hydroxy-1-[3-hydroxy-2-(hydroxymethyl)phenyl]pent-1-en-3-yl]oxy}methyl)phenyl]pent-4-ene-2,3-diol
(1s,2s,5s,6r,7s)-7-(3,4-dimethoxyphenyl)-1,3-dimethoxy-6-methyl-8-oxo-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-en-2-yl acetate
(9r,10r,11r)-3,4,5,11,19-pentamethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2(7),3,5,13,18-hexaene
2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(3-phenylpropoxy)oxane-3,4,5-triol
(1r,2s)-2-[(1s)-3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate
(2s)-2-({[(2s)-1-[(2s)-2-{[(2s)-2-amino-1-hydroxy-3-(c-hydroxycarbonimidoyl)propylidene]amino}-3-(c-hydroxycarbonimidoyl)propanoyl]pyrrolidin-2-yl](hydroxy)methylidene}amino)-3-hydroxypropanoic acid
(2r,2as,4as,7r,7as,7br)-3-formyl-2a,7-dihydroxy-6,6,7b-trimethyl-1h,2h,4ah,5h,7h,7ah-cyclobuta[e]inden-2-yl 2-hydroxy-4-methoxy-6-methylbenzoate
(1r,2r)-2-[(1s)-1,2-dimethoxy-4-oxo-5-(prop-2-en-1-yl)cyclohexa-2,5-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate
(3s)-3-butyl-7-(2,4-dihydroxy-6-pentylphenoxy)-3-hydroxy-5-methoxy-2-benzofuran-1-one
(1s,2r,8s,9s,11r)-10-(acetyloxy)-9-hydroxy-12,12-dimethyl-6-methylidene-15-oxo-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadec-13-en-7-yl acetate
2-[(8s,9s)-9-[(3-methylbutanoyl)oxy]-2-oxo-8h,9h-furo[2,3-h]chromen-8-yl]propan-2-yl 3-methylbutanoate
5-{[(3r,4r,5s)-5-ethoxy-4-[(3,4,5-trimethoxyphenyl)methyl]oxolan-3-yl]methyl}-2h-1,3-benzodioxole
(1s,15s,18s)-4,5,6,9,10,11-hexamethoxy-18-methyl-17-oxatetracyclo[13.2.1.0²,⁷.0⁸,¹³]octadeca-2(7),3,5,8(13),9,11-hexaene
(3r)-3-[(7r,8s)-5-(acetyloxy)-2,2,7,8-tetramethyl-6-oxo-7h,8h-pyrano[3,2-g]chromen-10-yl]hexanoic acid
3-({6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl}oxy)-2-methylidene-3-oxopropyl 2-(hydroxymethyl)but-2-enoate
11,11,15-trimethyl-16-(1,2,3-trihydroxy-3-methylbutyl)-6,10,19-trioxapentacyclo[13.3.1.0²,⁷.0⁹,¹⁸.0¹²,¹⁷]nonadeca-1,3,7,9(18)-tetraen-5-one
(3ar,4r,6r,8r,8ar,9ar)-8-hydroxy-5,8a-dimethyl-3-methylidene-4-[(2-methylprop-2-enoyl)oxy]-2-oxo-3ah,4h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-6-yl 3-methylbut-2-enoate
3'-(acetyloxy)-9'-hydroxy-2,4'b,7'-trimethyl-8'-methylidene-1',4'-dioxo-5',6',7',8'a,9',10'-hexahydro-3'h-spiro[cyclopropane-1,2'-phenanthren]-10'-yl acetate
(1r,14s,15r,16s)-4,5,6,9,10,11-hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.0²,⁷.0⁸,¹³]heptadeca-2(7),3,5,8(13),9,11-hexaene
(3ar,4s,5r,6s,7r,7ar)-6-ethenyl-6-methyl-3-methylidene-7-[(2-methylpropanoyl)oxy]-2-oxo-5-(3-oxoprop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-4-yl (2z)-2-methylbut-2-enoate
5-[2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-4,7-dimethoxy-2h-1,3-benzodioxole
4,5,6,9,10,11-hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.0²,⁷.0⁸,¹³]heptadeca-2(7),3,5,8(13),9,11-hexaene
5-[2-({[2-(3,4-dihydroxypent-1-en-1-yl)-6-hydroxyphenyl]methoxy}methyl)-3-hydroxyphenyl]pent-4-ene-2,3-diol
3-[5-(acetyloxy)-2,2,7,8-tetramethyl-6-oxo-7h,8h-pyrano[3,2-g]chromen-10-yl]hexanoic acid
[2-(3,4-dimethoxyphenyl)-4-[(3,4-dimethoxyphenyl)methyl]oxolan-3-yl]methyl acetate
(1r,2s)-2-[(1r)-3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate
(1s,3ar,4s,6ar)-1-(3,4-dimethoxyphenyl)-4-(3,4,5-trimethoxy-2-methylphenyl)-hexahydrofuro[3,4-c]furan
[10-(acetyloxy)-1,1-dimethyl-4,9-dioxo-7-(3-oxoprop-1-en-2-yl)-4b,5,6,7,8,8a,10,10a-octahydrophenanthren-4a-yl]methyl acetate
(1r,2s,5r,6r,9s,10s,11r,13r)-9-methyl-5-{[(2z)-2-methylbut-2-enoyl]oxy}-14-methylidene-4-oxo-3,12-dioxatetracyclo[7.5.0.0²,⁶.0¹¹,¹³]tetradecan-10-yl (2e)-2-methylbut-2-enoate
5-(acetyloxy)-4a-hydroxy-4,4,11b-trimethyl-7-methylidene-1-oxo-2h,3h,5h,6h,6ah,11h,11ah-phenanthro[3,2-b]furan-6-yl acetate
3-({6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl}oxy)-2-(hydroxymethylidene)-3-oxopropyl 2-methylbut-2-enoate
(9s,10s)-3,4,5,8,19-pentamethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2(7),3,5,13,18-hexaene
5-[(1s,2r,3s,4r)-2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-4,7-dimethoxy-2h-1,3-benzodioxole
6-[(acetyloxy)methyl]-9-hydroxy-6,9a-dimethyl-3-oxo-octahydro-1h-naphtho[1,2-c]furan-5-yl benzoate
3,6,9-trimethyl-4-[(2-methylpropanoyl)oxy]-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-3-yl 2-methylbut-2-enoate
(1r,2s)-2-[3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate
9-chloro-4,6-dihydroxy-13-isopropyl-10-methyl-10-(4-methylpent-3-en-1-yl)tetracyclo[7.5.1.0¹,¹¹.0²,⁷]pentadeca-2,4,6-triene-8,15-dione
C25H31ClO4 (430.19107560000003)
(9s,10s,11r)-3,4,5,11,19-pentamethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2(7),3,5,13,18-hexaene
2-(2-hydroxy-7-{[6-(hydroxymethyl)octa-2,4-dienoyl]oxy}-8,8a-dimethyl-3-oxo-7,8-dihydro-1h-naphthalen-2-yl)prop-2-enoic acid
3-(acetyloxy)-9-hydroxy-7,11,16,16-tetramethyl-10,14-dioxotricyclo[9.3.1.1⁴,⁸]hexadeca-1,7,12-trien-6-yl acetate
methyl (1r,2s,11r,12r,14r,15r)-11,15-dihydroxy-2,6,6,11,14-pentamethyl-17-methylidene-8,16-dioxo-7-oxatetracyclo[12.2.1.0²,¹².0⁵,¹⁰]heptadeca-4,9-diene-1-carboxylate
[(1r,2s,3as,3br,5ar,6r,7r,8s,9ar,9bs,11ar)-1-ethenyl-2,6,7-trihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid
C21H34O7S (430.20251340000004)
5-({5-ethoxy-4-[(3,4,5-trimethoxyphenyl)methyl]oxolan-3-yl}methyl)-2h-1,3-benzodioxole
(1r)-1-[5,7-dihydroxy-6-(3-methylbut-2-en-1-yl)-8-(3-methylbutanoyl)-2-oxochromen-4-yl]propyl acetate
(1s,2r,3r,3'ar,5'ar,7's,9'as,9'bs)-7'-hydroxy-2,9'a-dimethyl-1'-oxo-3-(6-oxopyran-3-yl)-octahydro-3'ah-spiro[cyclopentane-1,3'-naphtho[1,2-c]furan]-2-carboxylic acid
3,14-dihydroxy-4-methoxy-6,7,9,17,18,20-hexamethyl-2,5,16-trioxapentacyclo[11.7.0.0³,¹¹.0⁴,⁸.0¹⁵,¹⁹]icosa-1(20),8,13,15(19)-tetraen-10-one
(7r,9s)-9-(3,4-dimethoxyphenyl)-4-methoxy-7,8-bis(methoxymethyl)-2h,6h,7h,8h,9h-naphtho[1,2-d][1,3]dioxole
10-(acetyloxy)-9-hydroxy-12,12-dimethyl-6-methylidene-15-oxo-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadec-13-en-7-yl acetate
4-(2,4-dihydroxy-6-pentylbenzoyloxy)-2-hydroxy-6-pentylbenzoic acid
(1'r,2r,3's,4r,4's,7's,8'r,9'r,10's,11's)-3',9',11'-trihydroxy-4-(1-hydroxyethyl)-8'-(2-hydroxypropan-2-yl)-10'-methoxy-1'-methyl-5'-oxaspiro[oxolane-2,2'-tricyclo[5.3.1.0⁴,¹¹]undecane]-5,6'-dione
(1'r,2s,3'r,4s,4'r,7's,8's,9'r,10's,11'r)-3',9',11'-trihydroxy-4-[(1s)-1-hydroxyethyl]-8'-(2-hydroxypropan-2-yl)-10'-methoxy-1'-methyl-5'-oxaspiro[oxolane-2,2'-tricyclo[5.3.1.0⁴,¹¹]undecane]-5,6'-dione
(3ar,4r,6r,8r,8ar,9ar)-8-hydroxy-5,8a-dimethyl-3-methylidene-4-[(2-methylprop-2-enoyl)oxy]-2-oxo-3ah,4h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-6-yl (2e)-2-methylbut-2-enoate
(1r,2r,4r,6r,8s,9z,11r)-4,9-dimethyl-14-methylidene-8-[(2-methylprop-2-enoyl)oxy]-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-2-yl (2z)-2-methylbut-2-enoate
(5r,6s,7s)-5-(3,4-dimethoxyphenyl)-4-methoxy-6,7-bis(methoxymethyl)-2h,5h,6h,7h,8h-naphtho[2,3-d][1,3]dioxole
[(1r,3r,3as,3br,5ar,6r,7r,8s,9ar,9bs,11ar)-1-ethenyl-3,6,7-trihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid
C21H34O7S (430.20251340000004)
2-[(2r,7s,8r,8ar)-2-hydroxy-7-{[(2e,4e,6s)-6-(hydroxymethyl)octa-2,4-dienoyl]oxy}-8,8a-dimethyl-3-oxo-7,8-dihydro-1h-naphthalen-2-yl]prop-2-enoic acid
2,3-bis(acetyloxy)-4,5-dihydroxy-6-[(3-methylbutanoyl)oxy]cyclohexyl 2-methylbut-2-enoate
(7s,8s,9r)-9-(3,4-dimethoxyphenyl)-4-methoxy-7,8-bis(methoxymethyl)-2h,6h,7h,8h,9h-naphtho[1,2-d][1,3]dioxole
(1s,2s,5r,7s,8s,10s,11r,13r)-10-(acetyloxy)-12,12-dimethyl-6-methylidene-9,16-dioxo-14-oxapentacyclo[11.2.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-yl acetate
3-butyl-7-(2,4-dihydroxy-6-pentylphenoxy)-3-hydroxy-5-methoxy-2-benzofuran-1-one
6-ethyl-4-hydroxy-5-methyl-3-{[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)-5-(2-methylpropanoyl)phenyl]methyl}pyran-2-one
2-[2,6-dimethoxy-3-(prop-2-en-1-yl)phenoxy]-1-(3,4-dimethoxyphenyl)propyl acetate
5,6,7-trimethoxy-4-(3,4,5-trimethoxyphenyl)-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan
(3s,4's,5'r)-5'-[(3z)-4,8-dimethylnona-3,7-dien-1-yl]-4',8-dihydroxy-5'-methylspiro[1,4-benzodioxepine-3,2'-oxolane]-2,5-dione
(3r)-3-[(7r,8r)-5-(acetyloxy)-2,2,7,8-tetramethyl-6-oxo-7h,8h-pyrano[3,2-g]chromen-10-yl]hexanoic acid
(3r)-3-[(7s,8r)-5-(acetyloxy)-2,2,7,8-tetramethyl-6-oxo-7h,8h-pyrano[3,2-g]chromen-10-yl]hexanoic acid
[(2s,3r,4r)-2-(3,4-dimethoxyphenyl)-4-[(3,4-dimethoxyphenyl)methyl]oxolan-3-yl]methyl acetate
(1s,2s,5r,7r,8s,9s,10s,11r)-10-(acetyloxy)-9-hydroxy-12,12-dimethyl-6-methylidene-15-oxo-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadec-13-en-7-yl acetate
(2s,3r,4r,5r,6s)-2-{[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(2-phenylethoxy)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
15,17,18-trihydroxy-18-(methoxycarbonyl)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-2-carboxylic acid
(3s,3ar,4s,9ar,9bs)-3,6,9-trimethyl-3-[(2-methylpropanoyl)oxy]-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-4-yl (2z)-2-methylbut-2-enoate
(1r,2s,4r,5r,6r,7r,10s,11s,14s,16s)-5,14,16-trihydroxy-7-methyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.0²,⁴.0²,⁷.0¹¹,¹⁶]octadecane-11-carbaldehyde
2-[3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate
(4ar,5s,6r,6ar,11as,11br)-5-(acetyloxy)-4a-hydroxy-4,4,11b-trimethyl-7-methylidene-1-oxo-2h,3h,5h,6h,6ah,11h,11ah-phenanthro[3,2-b]furan-6-yl acetate
(2s,3r,4r,5r,6s)-2-{[(2r,3r,4s,5r,6r)-3,5-dihydroxy-2-(hydroxymethyl)-6-(2-phenylethoxy)oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol
10-(acetyloxy)-12,12-dimethyl-6-methylidene-9,16-dioxo-14-oxapentacyclo[11.2.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-yl acetate
9-hydroxy-4,6-bis(4-hydroxyphenyl)-11-isopropyl-9-methyltricyclo[5.2.2.0²,⁶]undeca-4,10-diene-3,8-dione
3,4,5,11,19-pentamethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2(7),3,5,13,18-hexaene
(1s,2s)-2-[2,6-dimethoxy-3-(prop-2-en-1-yl)phenoxy]-1-(3,4-dimethoxyphenyl)propyl acetate
6-ethenyl-6-methyl-3-methylidene-7-[(2-methylpropanoyl)oxy]-2-oxo-5-(3-oxoprop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-4-yl 2-methylbut-2-enoate
5-(2-{[2-(3,4-dihydroxypent-1-en-1-yl)-4-hydroxy-3-(hydroxymethyl)phenyl]methyl}-3-hydroxyphenyl)pent-4-ene-2,3-diol
8-hydroxy-5,8a-dimethyl-3-methylidene-4-[(2-methylprop-2-enoyl)oxy]-2-oxo-3ah,4h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-6-yl 2-methylbut-2-enoate
6-(3,4-dimethoxyphenyl)-3,5-dimethoxy-7-methyl-4-oxo-1-(prop-2-en-1-yl)bicyclo[3.2.1]oct-2-en-8-yl acetate
7'-hydroxy-2,9'a-dimethyl-1'-oxo-3-(2-oxopyran-4-yl)-octahydro-3'ah-spiro[cyclopentane-1,3'-naphtho[1,2-c]furan]-2-carboxylic acid
(1s,5r,6s,7r,8r)-6-(3,4-dimethoxyphenyl)-3,5-dimethoxy-7-methyl-4-oxo-1-(prop-2-en-1-yl)bicyclo[3.2.1]oct-2-en-8-yl acetate
4,5,6,9,10,11-hexamethoxy-18-methyl-17-oxatetracyclo[13.2.1.0²,⁷.0⁸,¹³]octadeca-2(7),3,5,8(13),9,11-hexaene
5-[(2r,3s)-2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-4,7-dimethoxy-2h-1,3-benzodioxole
1-(3,4-dimethoxyphenyl)-4-(3,4,5-trimethoxy-2-methylphenyl)-hexahydrofuro[3,4-c]furan
5-{3-hydroxy-2-[({4-hydroxy-1-[3-hydroxy-2-(hydroxymethyl)phenyl]pent-1-en-3-yl}oxy)methyl]phenyl}pent-4-ene-2,3-diol
[(2r,3s,4s,5r,6r)-5-(acetyloxy)-3,4-dihydroxy-6-{[(5r,6e)-5-hydroxy-7-methyl-3-methylidene-8-oxooct-6-en-1-yl]oxy}oxan-2-yl]methyl acetate
(1s)-1-[5,7-dihydroxy-6-(3-methylbut-2-en-1-yl)-8-[(2r)-2-methylbutanoyl]-2-oxochromen-4-yl]propyl acetate
5,14,16-trihydroxy-7-methyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.0²,⁴.0²,⁷.0¹¹,¹⁶]octadecane-11-carbaldehyde
2-{[4,5-dihydroxy-6-(hydroxymethyl)-2-(2-phenylethoxy)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
(1s,2s,5r,7r,8s,10s,11r,13r)-10-(acetyloxy)-12,12-dimethyl-6-methylidene-9,16-dioxo-14-oxapentacyclo[11.2.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-yl acetate
(2r,3s,4s,5r,6r)-2-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(3-phenylpropoxy)oxane-3,4,5-triol
(9s,10s)-8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl 3-methylbutanoate
(4s,5r,10r)-4-hydroxy-5-{[(4s,5r,10r)-4-hydroxy-10-methyl-2,7-dioxooxecan-5-yl]sulfanyl}-10-methyloxecane-2,7-dione
[(2r,3r,7r,9as,9bs,10ar)-2-(acetyloxy)-7-ethenyl-4,9a-dihydroxy-3,7-dimethyl-5-oxo-1h,2h,8h,9h,10h,10ah-cyclopropa[f]phenanthren-3-yl]methyl acetate
(7s,8r,9s)-9-(3,4-dimethoxyphenyl)-4-methoxy-7,8-bis(methoxymethyl)-2h,6h,7h,8h,9h-naphtho[1,2-d][1,3]dioxole
(3r,4r,5s,7r)-3,4-dihydroxy-6-(prop-2-en-1-yl)-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-9(16),10,12,14-tetraen-7-yl (2e)-3-phenylprop-2-enoate
C26H26N2O4 (430.18924760000004)