Exact Mass: 526.2629860000001
Exact Mass Matches: 526.2629860000001
Found 500 metabolites which its exact mass value is equals to given mass value 526.2629860000001
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Ganosporeric acid A
Constituent of rape oil and fish oils as glycerideand is also in other plant oils, e.g. false flax (Camelina sativa), and swede (Brassica napobrassica) Ganosporeric acid A is found in mushrooms. Ganosporeric acid A is a constituent of Ganoderma lucidum (reishi). Ganosporeric acid A, a natural product, is isolated from the ether-soluble fraction of the spores of Ganoderma lucidum. Ganosporeric acid A can be used for the research of liver injury[1]. Ganosporeric acid A, a natural product, is isolated from the ether-soluble fraction of the spores of Ganoderma lucidum. Ganosporeric acid A can be used for the research of liver injury[1].
Withangulatin A
Withangulatin A is found in fruits. Withangulatin A is a constituent of the famine food Physalis angulata (cutleaf ground cherry).
Absintholide
Constituent of Artemisia absinthium (wormwood). Absintholide is found in alcoholic beverages and herbs and spices. Absintholide is found in alcoholic beverages. Absintholide is a constituent of Artemisia absinthium (wormwood).
I-Bimetrol
Iganidipine
N-(1-(1,2-Dihydro-1-methanesulfonylspiro(3H-indole-3,4'-piperidine-1'-yl)carbonyl)-4-phenylbutyl)-2-amino-2-methylpropanamide hydrochloride
Methyl 1-(3,4-dimethoxyphenyl)-3-(3-ethylpentyl)-4-hydroxy-6,7,8-trimethoxynaphthalene-2-carboxylate
Val-Phe-Val-Tyr
12alpha-acetoxyazadironolide|12??-Acetoxyazadironolide
7alpha,12alpha-diacetoxy-11beta-hydroxyneotecleanin|7??,12??-Diacetoxy-11??-hydroxyneotecleanin|zumsenol
(17S,18R,20R,22R)-4beta-acetyloxy-5beta,6beta:18,20-diepoxy-18-hydroxy-1-oxowitha-2,24-dienolide
2-O-beta-D-glucopyranosyl-4-carboxyatractyligenin|2beta-O-beta-D-glucopyranosyl-15alpha-hydroxy-kaur-16-en-18,19-dicarboxylic acid
6-O-(8-hydroxy-2,6-dimethyl-2(E),6(E)-octadienoyl)-6beta-hydroxyboschnaloside
methyl 1alpha,2beta,3alpha,6,8alpha,14beta-hexahydroxy[4,2,110,30,11,4]tricyclomeliac-7-oate
(3R,9R)-5-megastigmen-3,9-diol-3-O-(6-galloyl)-beta-D-glucopyranoside
1beta,2beta,3beta,4beta,5beta,6beta,7alpha,24betaoctaol-spirost-25(27)-en|tupisteroide C
11-O-acetyl-12-O-benzoyl-17beta-marsdenin|5,6-didehydrocynafogenin
7alpha,12alpha-diacetoxy-21-hydroxy-24,25,26,27-tetranor-3-oxoapotirucalla-1,14,20(22)-trien-23,21-olide|turraparvin C
5beta-acetoxy-4beta,10-diangeloyloxy-2beta,3beta,8,11-tetrahydroxy-bisabol-7(14)-ene
(20R,22R)-15alpha-acetoxy-5beta(6),16beta(17)-diepoxy-14beta-hydroxy-1-oxo-witha-2,24-dienolide|4-dehydroxyphysagulin C|physagulin H
Ganosporeric acid A
Ganosporeric acid A is a triterpenoid. (2R,6R)-2-methyl-4-oxo-6-[(10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3,7,11,12,15-pentaoxo-1,2,5,6,16,17-hexahydrocyclopenta[a]phenanthren-17-yl]heptanoic acid is a natural product found in Ganoderma lucidum with data available. Ganosporeric acid A, a natural product, is isolated from the ether-soluble fraction of the spores of Ganoderma lucidum. Ganosporeric acid A can be used for the research of liver injury[1]. Ganosporeric acid A, a natural product, is isolated from the ether-soluble fraction of the spores of Ganoderma lucidum. Ganosporeric acid A can be used for the research of liver injury[1].
Withangulatin A
Withangulatin A is a withanolide. Withangulatin A is a natural product found in Physalis angulata, Physalis lagascae, and other organisms with data available.
[6-acetyloxy-7-hydroxy-1-(3-methylbutanoyloxy)-7-(3-methylbutanoyloxymethyl)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate
[6-acetyloxy-7-hydroxy-1-(3-methylbutanoyloxy)-7-(3-methylbutanoyloxymethyl)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate [IIN-based on: CCMSLIB00000847103]
[6-acetyloxy-7-hydroxy-1-(3-methylbutanoyloxy)-7-(3-methylbutanoyloxymethyl)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate [IIN-based: Match]
Asp Phe Phe Val
Asp Phe Val Phe
Asp His Lys Gln
Asp His Gln Lys
Asp Lys His Gln
Asp Lys Gln His
Asp Gln His Lys
Asp Gln Lys His
Asp Val Phe Phe
Glu His Lys Asn
Glu His Asn Lys
Glu Lys His Asn
Glu Lys Asn His
Glu Asn His Lys
Glu Asn Lys His
Phe Asp Phe Val
Phe Asp Val Phe
Phe Phe Asp Val
Phe Phe Ile Thr
Phe Phe Leu Thr
Phe Phe Thr Ile
Phe Phe Thr Leu
Phe Phe Val Asp
Phe Ile Phe Thr
Phe Ile Thr Phe
Phe Leu Phe Thr
Phe Leu Thr Phe
Phe Pro Thr Tyr
Phe Pro Tyr Thr
Phe Thr Phe Ile
Phe Thr Phe Leu
Phe Thr Ile Phe
Phe Thr Leu Phe
Phe Thr Pro Tyr
Phe Thr Tyr Pro
Phe Val Asp Phe
Phe Val Phe Asp
Phe Val Val Tyr
Phe Val Tyr Val
Phe Tyr Pro Thr
Phe Tyr Thr Pro
Phe Tyr Val Val
Gly His Lys Trp
Gly His Trp Lys
Gly Lys His Trp
Gly Lys Trp His
Gly Trp His Lys
Gly Trp Lys His
His Asp Lys Gln
His Asp Gln Lys
His Glu Lys Asn
His Glu Asn Lys
His Gly Lys Trp
His Gly Trp Lys
His Lys Asp Gln
His Lys Glu Asn
His Lys Gly Trp
His Lys Asn Glu
His Lys Gln Asp
His Lys Trp Gly
His Asn Glu Lys
His Asn Lys Glu
His Asn Arg Thr
C20H34N10O7 (526.2611813999999)
His Asn Thr Arg
C20H34N10O7 (526.2611813999999)
His Gln Asp Lys
His Gln Lys Asp
His Gln Arg Ser
C20H34N10O7 (526.2611813999999)
His Gln Ser Arg
C20H34N10O7 (526.2611813999999)
His Arg Asn Thr
C20H34N10O7 (526.2611813999999)
His Arg Gln Ser
C20H34N10O7 (526.2611813999999)
His Arg Ser Gln
C20H34N10O7 (526.2611813999999)
His Arg Thr Asn
C20H34N10O7 (526.2611813999999)
His Ser Gln Arg
C20H34N10O7 (526.2611813999999)
His Ser Arg Gln
C20H34N10O7 (526.2611813999999)
His Thr Asn Arg
C20H34N10O7 (526.2611813999999)
His Thr Arg Asn
C20H34N10O7 (526.2611813999999)
His Trp Gly Lys
His Trp Lys Gly
Ile Phe Phe Thr
Ile Phe Thr Phe
Ile Met Thr Tyr
Ile Met Tyr Thr
Ile Thr Phe Phe
Ile Thr Met Tyr
Ile Thr Tyr Met
Ile Tyr Met Thr
Ile Tyr Thr Met
Lys Asp His Gln
Lys Asp Gln His
Lys Glu His Asn
Lys Glu Asn His
Lys Gly His Trp
Lys Gly Trp His
Lys His Asp Gln
Lys His Glu Asn
Lys His Gly Trp
Lys His Asn Glu
Lys His Gln Asp
Lys His Trp Gly
Lys Asn Glu His
Lys Asn His Glu
Lys Gln Asp His
Lys Gln His Asp
Lys Trp Gly His
Lys Trp His Gly
Leu Phe Phe Thr
Leu Phe Thr Phe
Leu Met Thr Tyr
Leu Met Tyr Thr
Leu Thr Phe Phe
Leu Thr Met Tyr
Leu Thr Tyr Met
Leu Tyr Met Thr
Leu Tyr Thr Met
Met Ile Thr Tyr
Met Ile Tyr Thr
Met Leu Thr Tyr
Met Leu Tyr Thr
Met Thr Ile Tyr
Met Thr Leu Tyr
Met Thr Tyr Ile
Met Thr Tyr Leu
Met Tyr Ile Thr
Met Tyr Leu Thr
Met Tyr Thr Ile
Met Tyr Thr Leu
Asn Glu His Lys
Asn Glu Lys His
Asn His Glu Lys
Asn His Lys Glu
Asn His Arg Thr
C20H34N10O7 (526.2611813999999)
Asn His Thr Arg
C20H34N10O7 (526.2611813999999)
Asn Lys Glu His
Asn Lys His Glu
Asn Arg His Thr
C20H34N10O7 (526.2611813999999)
Asn Arg Thr His
C20H34N10O7 (526.2611813999999)
Asn Thr His Arg
C20H34N10O7 (526.2611813999999)
Asn Thr Arg His
C20H34N10O7 (526.2611813999999)
Pro Phe Thr Tyr
Pro Phe Tyr Thr
Pro Pro Gln Trp
C26H34N6O6 (526.2539704000001)
Pro Pro Trp Gln
C26H34N6O6 (526.2539704000001)
Pro Gln Pro Trp
C26H34N6O6 (526.2539704000001)
Pro Gln Trp Pro
C26H34N6O6 (526.2539704000001)
Pro Thr Phe Tyr
Pro Thr Tyr Phe
Pro Trp Pro Gln
C26H34N6O6 (526.2539704000001)
Pro Trp Gln Pro
C26H34N6O6 (526.2539704000001)
Pro Tyr Phe Thr
Pro Tyr Thr Phe
Gln Asp His Lys
Gln Asp Lys His
Gln His Asp Lys
Gln His Lys Asp
Gln His Arg Ser
C20H34N10O7 (526.2611813999999)
Gln His Ser Arg
C20H34N10O7 (526.2611813999999)
Gln Lys Asp His
Gln Lys His Asp
Gln Pro Pro Trp
C26H34N6O6 (526.2539704000001)
Gln Pro Trp Pro
C26H34N6O6 (526.2539704000001)
Gln Arg His Ser
C20H34N10O7 (526.2611813999999)
Gln Arg Ser His
C20H34N10O7 (526.2611813999999)
Gln Ser His Arg
C20H34N10O7 (526.2611813999999)
Gln Ser Arg His
C20H34N10O7 (526.2611813999999)
Gln Trp Pro Pro
C26H34N6O6 (526.2539704000001)
Arg His Asn Thr
C20H34N10O7 (526.2611813999999)
Arg His Gln Ser
C20H34N10O7 (526.2611813999999)
Arg His Ser Gln
C20H34N10O7 (526.2611813999999)
Arg His Thr Asn
C20H34N10O7 (526.2611813999999)
Arg Asn His Thr
C20H34N10O7 (526.2611813999999)
Arg Asn Thr His
C20H34N10O7 (526.2611813999999)
Arg Gln His Ser
C20H34N10O7 (526.2611813999999)
Arg Gln Ser His
C20H34N10O7 (526.2611813999999)
Arg Ser His Gln
C20H34N10O7 (526.2611813999999)
Arg Ser Gln His
C20H34N10O7 (526.2611813999999)
Arg Thr His Asn
C20H34N10O7 (526.2611813999999)
Arg Thr Asn His
C20H34N10O7 (526.2611813999999)
Ser His Gln Arg
C20H34N10O7 (526.2611813999999)
Ser His Arg Gln
C20H34N10O7 (526.2611813999999)
Ser Gln His Arg
C20H34N10O7 (526.2611813999999)
Ser Gln Arg His
C20H34N10O7 (526.2611813999999)
Ser Arg His Gln
C20H34N10O7 (526.2611813999999)
Ser Arg Gln His
C20H34N10O7 (526.2611813999999)
Thr Phe Phe Ile
Thr Phe Phe Leu
Thr Phe Ile Phe
Thr Phe Leu Phe
Thr Phe Pro Tyr
Thr Phe Tyr Pro
Thr His Asn Arg
C20H34N10O7 (526.2611813999999)
Thr His Arg Asn
C20H34N10O7 (526.2611813999999)
Thr Ile Phe Phe
Thr Ile Met Tyr
Thr Ile Tyr Met
Thr Leu Phe Phe
Thr Leu Met Tyr
Thr Leu Tyr Met
Thr Met Ile Tyr
Thr Met Leu Tyr
Thr Met Tyr Ile
Thr Met Tyr Leu
Thr Asn His Arg
C20H34N10O7 (526.2611813999999)
Thr Asn Arg His
C20H34N10O7 (526.2611813999999)
Thr Pro Phe Tyr
Thr Pro Tyr Phe
Thr Arg His Asn
C20H34N10O7 (526.2611813999999)
Thr Arg Asn His
C20H34N10O7 (526.2611813999999)
Thr Tyr Phe Pro
Thr Tyr Ile Met
Thr Tyr Leu Met
Thr Tyr Met Ile
Thr Tyr Met Leu
Thr Tyr Pro Phe
Val Asp Phe Phe
Val Phe Asp Phe
Val Phe Phe Asp
Val Phe Val Tyr
Val Phe Tyr Val
Val Val Phe Tyr
Val Val Tyr Phe
Val Tyr Phe Val
Val Tyr Val Phe
Trp Gly His Lys
Trp Gly Lys His
Trp His Gly Lys
Trp His Lys Gly
Trp Lys Gly His
Trp Lys His Gly
Trp Pro Pro Gln
C26H34N6O6 (526.2539704000001)
Trp Pro Gln Pro
C26H34N6O6 (526.2539704000001)
Trp Gln Pro Pro
C26H34N6O6 (526.2539704000001)
Tyr Phe Pro Thr
Tyr Phe Thr Pro
Tyr Phe Val Val
Tyr Ile Met Thr
Tyr Ile Thr Met
Tyr Leu Met Thr
Tyr Leu Thr Met
Tyr Met Ile Thr
Tyr Met Leu Thr
Tyr Met Thr Ile
Tyr Met Thr Leu
Tyr Pro Phe Thr
Tyr Pro Thr Phe
Tyr Thr Phe Pro
Tyr Thr Ile Met
Tyr Thr Leu Met
Tyr Thr Met Ile
Tyr Thr Met Leu
Tyr Thr Pro Phe
Tyr Val Phe Val
Tyr Val Val Phe
Absintholide
2-O-(beta-D-galactopyranosyl-(1->6)-beta-D-galactopyranosyl) 2S-hydroxyundecanoic acid
Applanoic acid E
Applanoic acid F
Dequalinium Chloride
C30H40Cl2N4 (526.2629860000001)
C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D000890 - Anti-Infective Agents
2,2-(Vinylenedi-p-phenylene)bis[5-tert-butylbenzoxazole]
Argatroban
C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent > C173066 - Direct Thrombin Inhibitor D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D015842 - Serine Proteinase Inhibitors D006401 - Hematologic Agents > D000925 - Anticoagulants > D000991 - Antithrombins COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Iganidipine
C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent > C333 - Calcium Channel Blocker C93038 - Cation Channel Blocker
(2S,4S)-4-[4-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-1-piperazinyl]-2-(3-thiazolidinylcarbonyl)-1-pyrrolidinecarboxylic acid tert-butyl ester
Rabacfosadine
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor
[15-[1-(4,5-Dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-6,12-dihydroxy-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadeca-4,14-dien-13-yl] acetate
N-(1-(1,2-Dihydro-1-methanesulfonylspiro(3H-indole-3,4'-piperidine-1'-yl)carbonyl)-4-phenylbutyl)-2-amino-2-methylpropanamide hydrochloride
1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[(4S,7S,8S)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[2-(trifluoromethyl)phenyl]urea
1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
[6-acetyloxy-7-hydroxy-1-(3-methylbutanoyloxy)-7-(3-methylbutanoyloxymethyl)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate
N-[(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-(4-morpholinyl)propanamide
4-[[[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
N-[(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-(4-morpholinyl)propanamide
4-[[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide
N-[[(4R,5S)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide
1-[(4R,7R,8S)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
1-[(4R,7S,8S)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
1-[(4R,7S,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
N-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
4-[[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
4-[[[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
4-[[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
4-[[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
4-[[[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzoic acid
1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea
1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[3-(trifluoromethyl)phenyl]urea
N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide
N-[[(4S,5R)-8-(1-cyclohexenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide
(5S,6R,9R)-14-[[cyclopropyl(oxo)methyl]amino]-N-(2-fluorophenyl)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
1-[(4R,7R,8S)-5-acetyl-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(1,3-benzodioxol-5-yl)urea
1-[(4R,7R,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
1-[(4S,7R,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
1-[(4S,7S,8R)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
1-[(4S,7R,8S)-5-[cyclopropyl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(3-fluorophenyl)urea
N-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]cyclobutanecarboxamide
N-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
(2S,3S,4S,5R,6R)-6-[[(3R,5R,8S,9S,10S,13S,14S,17R)-17-carboxy-17-hydroxy-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
S-[2-[3-[[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]amino]propanoylamino]ethyl] 4,8-dimethylnonanethioate
[1-acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
(1-acetyloxy-3-phosphonooxypropan-2-yl) (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate
(1-butanoyloxy-3-phosphonooxypropan-2-yl) (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
(1-hexanoyloxy-3-phosphonooxypropan-2-yl) (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate
(1r,3br,4r,5ar,9ar,9br,11s,11as)-4-(acetyloxy)-1-(2-hydroxy-5-oxo-2h-furan-3-yl)-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
(1r,4s,7s,9s,10s,13r,15s)-15-hydroxy-9-methyl-14-methylidene-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5,5-dicarboxylic acid
(4s,5s,9s)-9-[(1r,2r)-1,2-dihydroxyhexyl]-4-hydroxy-5-[(1s)-1-hydroxyheptyl]-1,3-dioxo-4h,5h,8h,9h,10h-cyclonona[c]furan-6,7-dicarboxylic acid
2',5'-bis(acetyloxy)-1',7',9',10'-tetrahydroxy-8',12',15',15'-tetramethylspiro[oxirane-2,4'-tricyclo[9.3.1.0³,⁸]pentadecan]-11'-en-13'-yl acetate
2,9-bis(acetyloxy)-5,8,11-trihydroxy-3-(2-hydroxypropan-2-yl)-6,10-dimethyl-14-oxatetracyclo[8.6.0.0³,⁷.0¹³,¹⁶]hexadec-6-en-16-yl acetate
methyl (1r,3s,4ar,4bs,6r,8ar,10ar)-3-(acetyloxy)-6-[(2s,3r,4s,5r)-3,4-dihydroxy-2,5-dimethoxyoxolan-3-yl]-4b,10a-dimethyl-4,8-dioxo-decahydrophenanthrene-1-carboxylate
2-methoxy-4-(4-{3-methoxy-4-[(3-methylbutanoyl)oxy]phenyl}-hexahydrofuro[3,4-c]furan-1-yl)phenyl 3-methylbutanoate
9-(1,2-dihydroxyhexyl)-4-hydroxy-5-(1-hydroxyheptyl)-1,3-dioxo-4h,5h,8h,9h,10h-cyclonona[c]furan-6,7-dicarboxylic acid
(2r,18s,19r)-14,17,17,21,21,24-hexamethyl-16,22-dioxa-1,5-diazanonacyclo[17.13.2.0²,¹⁸.0³,¹⁵.0⁴,¹².0⁶,¹¹.0²³,³⁴.0²⁶,³³.0²⁷,³²]tetratriaconta-3(15),4(12),6(11),7,9,13,23(34),24,26(33),27(32),28,30-dodecaene
(1r,3br,4r,5ar,9ar,9br,11s,11as)-4-(acetyloxy)-1-[(5s)-5-hydroxy-2-oxo-5h-furan-3-yl]-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
(2r,6r)-6-[(1r,3ar,5ar,9as,11ar)-3a,6,6,9a,11a-pentamethyl-3,4,7,10,11-pentaoxo-1h,2h,5h,5ah,8h,9h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
(1s,2s,4s,7r,8r,9s,10s,12s,13s,16r)-4,7-bis(acetyloxy)-2,8,10,13-tetrahydroxy-5,9,17,17-tetramethyl-15-oxatetracyclo[7.6.1.1²,⁶.0¹³,¹⁶]heptadec-5-en-12-yl acetate
(1r,3br,4r,5ar,9ar,9br,11s,11as)-4-(acetyloxy)-1-[(2r)-2-hydroxy-5-oxo-2h-furan-3-yl]-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
14,17,17,21,21,24-hexamethyl-16,22-dioxa-1,5-diazanonacyclo[17.13.2.0²,¹⁸.0³,¹⁵.0⁴,¹².0⁶,¹¹.0²³,³⁴.0²⁶,³³.0²⁷,³²]tetratriaconta-3(15),4(12),6(11),7,9,13,23(34),24,26(33),27(32),28,30-dodecaene
(2s,18r,19s)-14,17,17,21,21,24-hexamethyl-16,22-dioxa-1,5-diazanonacyclo[17.13.2.0²,¹⁸.0³,¹⁵.0⁴,¹².0⁶,¹¹.0²³,³⁴.0²⁶,³³.0²⁷,³²]tetratriaconta-3(15),4(12),6(11),7,9,13,23(34),24,26(33),27(32),28,30-dodecaene
(1s,3s,5s,6as,7r,8r,10s,10as)-1-(acetyloxy)-10-hydroxy-3-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-5-yl 4-hydroxybenzoate
4-[(1r,3as,4r,6as)-4-{3-methoxy-4-[(3-methylbutanoyl)oxy]phenyl}-hexahydrofuro[3,4-c]furan-1-yl]-2-methoxyphenyl 3-methylbutanoate
(1r,3ar,3bs,7s,9ar,9br,11r,11as)-1-(acetyloxy)-1,3a,3b,7-tetrahydroxy-9a,11a-dimethyl-2h,3h,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl (2e)-3-phenylprop-2-enoate
(2r,3r)-2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-(3-hydroxy-3-methylbutyl)-8-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-2,3-dihydro-1-benzopyran-4-one
3,3,5-trimethyl-8-[(1s)-3,3,5-trimethyl-1h,2h,11h-pyrano[3,2-a]carbazol-1-yl]-11h-pyrano[3,2-a]carbazole
(1's,2s,2's,3'r,5's,7's,8's,9'r,10'r)-2',5'-bis(acetyloxy)-1',7',9',10'-tetrahydroxy-8',12',15',15'-tetramethylspiro[oxirane-2,4'-tricyclo[9.3.1.0³,⁸]pentadecan]-11'-en-13'-yl acetate
2-(acetyloxy)-3,8-dimethyl-5-(2-methyloxiran-2-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl 2-hydroxy-8-methyl-7-oxa-5,8-diazatricyclo[7.4.0.0²,⁶]trideca-1(13),9,11-triene-4-carboxylate
C29H38N2O7 (526.2678877999999)
12α-acetoxyazadironolide
{"Ingredient_id": "HBIN000701","Ingredient_name": "12\u03b1-acetoxyazadironolide","Alias": "NA","Ingredient_formula": "C30H38O8","Ingredient_Smile": "CC(=O)OC1CC2C3(C=CC(=O)C(C3CC(C2(C4=CCC(C14C)C5=CC(OC5=O)O)C)OC(=O)C)(C)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "128","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-hydroxy-2,7,9-trideacetylbaccatin i
{"Ingredient_id": "HBIN002621","Ingredient_name": "1-hydroxy-2,7,9-trideacetylbaccatin i","Alias": "NA","Ingredient_formula": "C26H38O11","Ingredient_Smile": "CC1=C2C(C(C3(C(CC(C4(C3C(C(C2(C)C)(CC1OC(=O)C)O)O)CO4)OC(=O)C)O)C)O)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10781","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
applanoxidic acid C
{"Ingredient_id": "HBIN016520","Ingredient_name": "applanoxidic acid C","Alias": "NA","Ingredient_formula": "C30H38O8","Ingredient_Smile": "CC(CC(=O)CC(C)(C1=CC(=O)C2(C1(C(=O)C=C3C24C(O4)CC5C3(CCC(=O)C5(C)C)C)C)C)O)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32363","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,3ar,3bs,7s,9ar,9bs,10s,11s,11as)-1-acetyl-10-(acetyloxy)-3a,3b,7-trihydroxy-9a,11a-dimethyl-1h,2h,3h,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl benzoate
16-hydroxy-2,6,14,17-tetramethyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecane-3,11,15-trione
4-formyl-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-5-yl 8-hydroxy-2,6-dimethylocta-2,6-dienoate
(1s)-3,3,5-trimethyl-1-{3,3,5-trimethyl-11h-pyrano[3,2-a]carbazol-10-yl}-1h,2h,11h-pyrano[3,2-a]carbazole
(1s,2s,5s,6r,8r,9r,12s,13r,17s,18s,20r)-6-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-8-hydroxy-6,13-dimethyl-14-oxo-7,19-dioxahexacyclo[10.9.0.0²,⁹.0⁵,⁹.0¹³,¹⁸.0¹⁸,²⁰]henicos-15-en-17-yl acetate
(2r,6r)-6-[(1r,3ar,9as,11ar)-3a,6,6,9a,11a-pentamethyl-3,4,7,10,11-pentaoxo-1h,2h,5h,5ah,8h,9h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
(1s,2s,4s,7r,8r,9s,10s,12s,13s,16r)-8,10-bis(acetyloxy)-7,12,13-trihydroxy-2-(2-hydroxypropan-2-yl)-5,9-dimethyl-15-oxatetracyclo[7.6.1.0²,⁶.0¹³,¹⁶]hexadec-5-en-4-yl acetate
(2s,6s)-6-[(3as,5ar,9as,11ar)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,7,11-trioxo-5h,5ah,8h,9h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-4-oxoheptanoic acid
3,3,5-trimethyl-8-{3,3,5-trimethyl-1h,2h,11h-pyrano[3,2-a]carbazol-1-yl}-11h-pyrano[3,2-a]carbazole
(1s,3br,4r,5ar,9ar,9br,11s,11as)-4-(acetyloxy)-1-(5-hydroxy-2-oxo-3h-furan-3-yl)-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
methyl (2r)-2-[(4s,4as,6as,7r,8r,9r,10s,10as,10br)-4-(furan-3-yl)-9,10,10a,10b-tetrahydroxy-8-(2-hydroxy-2-methylpropyl)-4a,8-dimethyl-2-oxo-octahydronaphtho[2,1-c]pyran-7-yl]-2-hydroxyacetate
6-hydroxy-2-methyl-4-oxo-6-{6,6,10,14,18-pentamethyl-7,13,17-trioxo-2-oxapentacyclo[9.7.0.0¹,³.0⁵,¹⁰.0¹⁴,¹⁸]octadeca-11,15-dien-15-yl}heptanoic acid
(1r,2r,3s,8r,11r,15s,16s,17s)-3-(acetyloxy)-15-(furan-3-yl)-2,7,7,11,16-pentamethyl-5,10-dioxo-6-oxatetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadec-12-en-17-yl acetate
4,7-bis(acetyloxy)-2,8,10,13-tetrahydroxy-5,9,17,17-tetramethyl-15-oxatetracyclo[7.6.1.1²,⁶.0¹³,¹⁶]heptadec-5-en-12-yl acetate
(1s,2s,4s,6r,7s,9r,13s,14r,16s,17s)-16-hydroxy-2,6,14,17-tetramethyl-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecane-3,11,15-trione
(1s,2r,7s,9r,11r,12s,13s,14s,16r,17s)-16-[(1r)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-12-hydroxy-2,17-dimethyl-3-oxo-8,15-dioxahexacyclo[9.8.0.0²,⁷.0⁷,⁹.0¹²,¹⁷.0¹⁴,¹⁶]nonadec-4-en-13-yl acetate
15-hydroxy-2,6,14,17-tetramethyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecane-3,11,16-trione
4,8-bis(acetyloxy)-3a-hydroxy-2,4a,7a-trimethyl-5-(2-methylprop-2-en-1-yl)-6-oxo-octahydro-s-indacen-1-yl benzoate
6-[(1r,5ar)-3a,6,6,9a,11a-pentamethyl-3,4,7,10,11-pentaoxo-1h,2h,5h,5ah,8h,9h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
n-(1-{[2-(acetyloxy)-8a-hydroxy-3,8-dimethyl-5-(prop-1-en-2-yl)-2,4a,5,6,7,8-hexahydro-1h-naphthalen-1-yl]oxy}-4-[2-(methylamino)phenyl]-1,4-dioxobutan-2-yl)carboximidic acid
C29H38N2O7 (526.2678877999999)
(1s,2s,5s,6r,8s,9r,12s,13r,17s,18s,20r)-6-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-8-hydroxy-6,13-dimethyl-14-oxo-7,19-dioxahexacyclo[10.9.0.0²,⁹.0⁵,⁹.0¹³,¹⁸.0¹⁸,²⁰]henicos-15-en-17-yl acetate
[2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-{3-[(3-methylbutanoyl)oxy]prop-1-en-1-yl}-2,3-dihydro-1-benzofuran-3-yl]methyl 3-methylbutanoate
(1r,2r,8s,9r,10s,11s,12r,14r,16s,17s)-10-(acetyloxy)-16-(furan-3-yl)-2,7,7,11,17-pentamethyl-5-oxo-6,13-dioxapentacyclo[9.8.0.0²,⁸.0¹²,¹⁴.0¹²,¹⁷]nonadec-3-en-9-yl acetate
(1r)-3,3,5-trimethyl-1-{3,3,5-trimethyl-11h-pyrano[3,2-a]carbazol-10-yl}-1h,2h,11h-pyrano[3,2-a]carbazole
(2e)-3-[(2r,3r)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-3-{[(3-methylbutanoyl)oxy]methyl}-2,3-dihydro-1-benzofuran-5-yl]prop-2-en-1-yl 3-methylbutanoate
(3e,5r,8s,9s,10r,13s,15s,16r,18z,24s,25s)-11-ethyl-2,9,20,24,27-pentahydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁸,¹⁵.0⁹,¹³]octacosa-1,3,18,20,26-pentaene-7,28-dione
C29H38N2O7 (526.2678877999999)
(5e)-6-[(1r,3ar,5ar,9as,11s,11ar)-11-hydroxy-3a,6,6,9a,11a-pentamethyl-3,4,7,10-tetraoxo-1h,2h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxohept-5-enoic acid
(1r,2r,6s,9r,11r,12r,16s,17s,18r,19r)-11-(acetyloxy)-16-(furan-3-yl)-19-hydroxy-8,8,12,17-tetramethyl-4-oxo-7-oxapentacyclo[10.7.0.0²,⁶.0²,⁹.0¹³,¹⁷]nonadec-13-en-18-yl acetate
(2r)-2-{[(2s)-2-{[(2r)-2-{[(2s)-2-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxy-3-methylbutylidene]amino}-1-hydroxy-3-methylbutylidene]amino}-3-phenylpropanoic acid
2-{[2-({2-[(2-amino-1-hydroxy-3-phenylpropylidene)amino]-1-hydroxy-3-methylbutylidene}amino)-1-hydroxy-3-methylbutylidene]amino}-3-(4-hydroxyphenyl)propanoic acid
6-{11-hydroxy-3a,6,6,9a,11a-pentamethyl-3,4,7,10-tetraoxo-1h,2h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxohept-5-enoic acid
n-[(2s)-1-{[(1s,2r,4ar,5r,8r,8ar)-2-(acetyloxy)-8a-hydroxy-3,8-dimethyl-5-(prop-1-en-2-yl)-2,4a,5,6,7,8-hexahydro-1h-naphthalen-1-yl]oxy}-4-[2-(methylamino)phenyl]-1,4-dioxobutan-2-yl]carboximidic acid
C29H38N2O7 (526.2678877999999)
16-[1-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-12-hydroxy-2,17-dimethyl-3-oxo-8,15-dioxahexacyclo[9.8.0.0²,⁷.0⁷,⁹.0¹²,¹⁷.0¹⁴,¹⁶]nonadec-4-en-13-yl acetate
4-(acetyloxy)-1-(5-hydroxy-2-oxo-5h-furan-3-yl)-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
(3e,5r,8s,9s,10r,11s,13s,15s,16r,18z,24s,25s)-11-ethyl-9,20,24,27,28-pentahydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁸,¹⁵.0⁹,¹³]octacosa-1(28),3,18,20,26-pentaene-2,7-dione
C29H38N2O7 (526.2678877999999)