Exact Mass: 576.2736416
Exact Mass Matches: 576.2736416
Found 500 metabolites which its exact mass value is equals to given mass value 576.2736416
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Anaerobilin
Bafetinib
Bafetinib is a tyrosine kinase inhibitor used to treat chronic myelogenous leukemia (CML), a cancer characterized by increased and unregulated growth of white blood cells in the bone marrow and the accumulation of these cells in the blood. Bafetinib is able to bind ABL with greater affinity than Imatinib (25-55 times more potent). It is therefore administered to patients with Imatinib resistance. Notably, Bafetinib is ineffective against the T315I mutation in BCR-ABL, and further research is necessary. C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors
Caseargrewiin C
A diterpenoid of the clerodane group isolated from the bark of Casearia grewiifolia and has been shown to exhibit antimalarial and antimycobacterial activity.
methyl-ent-15alpha-acetoxy-1alpha-(2-methyl-2,3-epoxybutyryloxy)-9alpha-hydroxy-7alpha-propionylyloxykaur-16-en-19-oate|methyl-ent-15alpha-acetoxy-1alpha-<2-methyl-2,3-epoxybutyryloxy>-9alpha-hydroxy-7alpha-propionylyloxykaur-16-en-19-oate
methyl-ent-1alpha7alpha-di<2-methyl-2,3-epoxybutyryloxy>-9alpha,15alpha-dihydroxykaur-16-en-19-oate|methyl-ent-1alpha7alpha-di[2-methyl-2,3-epoxybutyryloxy]-9alpha,15alpha-dihydroxykaur-16-en-19-oate
10-carboxy-5beta,14beta-dihydroxy-bufa-3,20,22-trienolid-5-O-beta-D-glucosid
(1S,3aR,5S,6R,7S,7aR)-1-(1-acetoxyethyl)octahydro-4-methylidene-7-[(2S)-2-methyloxyran-2-yl]-6-[(3-methylpentanoyl)oxy]-2-oxo-1H-inden-5-yl (2E)-4-acetoxy-3-methylpent-2-enoate
16alpha-[(6-O-sulfo-beta-D-glucopyranosyl)oxy]pregn-5-ene-3beta,20-diol
2,3-dihydro-3beta-methoxy-4beta-hydroxywithanolide E monoacetate
(1S,4S,5S,6R,7R,8R,9R,10S)-1,6,8,15-tetra-acetoxy-9-benzoyloxy-4-hydroxy-dihydro-beta-agarofuran
1-O-benzoylsalannic acid methyl ester|1-O-decinnamoyl-1-O-benzoylohchinin
5-hydroxyarenobufagin-3-O-4?,6?-dideoxy-alpha-L-allohexopyranose|kalantuboside B
10-methoxy-N(1)-methylburnamine-17-O-veratrate|10-methoxy-N1-methylburnamine-17-O-veratrate
17-methoxy-18-(3,4,5-trimethoxy-benzoyloxy)-yohimb-19-ene-16-carboxylic acid methyl ester|Deserpidein|Deserpideine|Deserpideine-B,HCl
C30H40O11_Methyl 5,6-diacetoxy-10-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxohexadecahydro-2H-naphtho[1,2-h]isochromene-2-carboxylate
methyl 5,6-diacetyloxy-10-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,8-trioxo-4a,5,6,6a,9,10,10b,11-octahydronaphtho[1,2-h]isochromene-2-carboxylate
methyl 5,6-diacetyloxy-10-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,8-trioxo-4a,5,6,6a,9,10,10b,11-octahydronaphtho[1,2-h]isochromene-2-carboxylate_major
Cys Ile Arg Trp
Cys Ile Trp Arg
Cys Leu Arg Trp
Cys Leu Trp Arg
Cys Arg Ile Trp
Cys Arg Leu Trp
Cys Arg Trp Ile
Cys Arg Trp Leu
Cys Trp Ile Arg
Cys Trp Leu Arg
Cys Trp Arg Ile
Cys Trp Arg Leu
Asp Glu Lys Trp
Asp Glu Trp Lys
Asp Lys Glu Trp
Asp Lys Trp Glu
Asp Met Arg Arg
Asp Arg Met Arg
Asp Arg Arg Met
Asp Arg Thr Trp
Asp Arg Trp Thr
Asp Thr Arg Trp
Asp Thr Trp Arg
Asp Trp Glu Lys
Asp Trp Lys Glu
Asp Trp Arg Thr
Asp Trp Thr Arg
Glu Asp Lys Trp
Glu Asp Trp Lys
Glu Lys Asp Trp
Glu Lys Trp Asp
Glu Arg Ser Trp
Glu Arg Trp Ser
Glu Ser Arg Trp
Glu Ser Trp Arg
Glu Trp Asp Lys
Glu Trp Lys Asp
Glu Trp Arg Ser
Glu Trp Ser Arg
Phe Phe Thr Tyr
Phe Phe Tyr Thr
Phe His His His
Phe Pro Gln Trp
C30H36N6O6 (576.2696195999999)
Phe Pro Trp Gln
C30H36N6O6 (576.2696195999999)
Phe Gln Pro Trp
C30H36N6O6 (576.2696195999999)
Phe Gln Trp Pro
C30H36N6O6 (576.2696195999999)
Phe Thr Phe Tyr
Phe Thr Tyr Phe
Phe Trp Pro Gln
C30H36N6O6 (576.2696195999999)
Phe Trp Gln Pro
C30H36N6O6 (576.2696195999999)
Phe Tyr Phe Thr
Phe Tyr Thr Phe
His Phe His His
His His Phe His
His His His Phe
His His Gln Arg
His His Arg Gln
His Gln His Arg
His Gln Arg His
His Arg His Gln
His Arg Gln His
Ile Cys Arg Trp
Ile Cys Trp Arg
Ile Met Gln Trp
Ile Met Trp Gln
Ile Gln Met Trp
Ile Gln Trp Met
Ile Arg Cys Trp
Ile Arg Trp Cys
Ile Trp Cys Arg
Ile Trp Met Gln
Ile Trp Gln Met
Ile Trp Arg Cys
Lys Asp Glu Trp
Lys Asp Trp Glu
Lys Glu Asp Trp
Lys Glu Trp Asp
Lys Trp Asp Glu
Lys Trp Glu Asp
Leu Cys Arg Trp
Leu Cys Trp Arg
Leu Met Gln Trp
Leu Met Trp Gln
Leu Gln Met Trp
Leu Gln Trp Met
Leu Arg Cys Trp
Leu Arg Trp Cys
Leu Trp Cys Arg
Leu Trp Met Gln
Leu Trp Gln Met
Leu Trp Arg Cys
Met Asp Arg Arg
Met Ile Gln Trp
Met Ile Trp Gln
Met Leu Gln Trp
Met Leu Trp Gln
Met Gln Ile Trp
Met Gln Leu Trp
Met Gln Trp Ile
Met Gln Trp Leu
Met Arg Asp Arg
Met Arg Arg Asp
Met Trp Ile Gln
Met Trp Leu Gln
Met Trp Gln Ile
Met Trp Gln Leu
Pro Phe Gln Trp
C30H36N6O6 (576.2696195999999)
Pro Phe Trp Gln
C30H36N6O6 (576.2696195999999)
Pro Gln Phe Trp
C30H36N6O6 (576.2696195999999)
Pro Gln Trp Phe
C30H36N6O6 (576.2696195999999)
Pro Trp Phe Gln
C30H36N6O6 (576.2696195999999)
Pro Trp Gln Phe
C30H36N6O6 (576.2696195999999)
Gln Phe Pro Trp
C30H36N6O6 (576.2696195999999)
Gln Phe Trp Pro
C30H36N6O6 (576.2696195999999)
Gln His His Arg
Gln His Arg His
Gln Ile Met Trp
Gln Ile Trp Met
Gln Leu Met Trp
Gln Leu Trp Met
Gln Met Ile Trp
Gln Met Leu Trp
Gln Met Trp Ile
Gln Met Trp Leu
Gln Pro Phe Trp
C30H36N6O6 (576.2696195999999)
Gln Pro Trp Phe
C30H36N6O6 (576.2696195999999)
Gln Arg His His
Gln Trp Phe Pro
C30H36N6O6 (576.2696195999999)
Gln Trp Ile Met
Gln Trp Leu Met
Gln Trp Met Ile
Gln Trp Met Leu
Gln Trp Pro Phe
C30H36N6O6 (576.2696195999999)
Arg Cys Ile Trp
Arg Cys Leu Trp
Arg Cys Trp Ile
Arg Cys Trp Leu
Arg Asp Met Arg
Arg Asp Arg Met
Arg Asp Thr Trp
Arg Asp Trp Thr
Arg Glu Ser Trp
Arg Glu Trp Ser
Arg His His Gln
Arg His Gln His
Arg Ile Cys Trp
Arg Ile Trp Cys
Arg Leu Cys Trp
Arg Leu Trp Cys
Arg Met Asp Arg
Arg Met Arg Asp
Arg Gln His His
Arg Arg Asp Met
Arg Arg Met Asp
Arg Ser Glu Trp
Arg Ser Trp Glu
Arg Thr Asp Trp
Arg Thr Trp Asp
Arg Trp Cys Ile
Arg Trp Cys Leu
Arg Trp Asp Thr
Arg Trp Glu Ser
Arg Trp Ile Cys
Arg Trp Leu Cys
Arg Trp Ser Glu
Arg Trp Thr Asp
Ser Glu Arg Trp
Ser Glu Trp Arg
Ser Arg Glu Trp
Ser Arg Trp Glu
Ser Val Trp Trp
C30H36N6O6 (576.2696195999999)
Ser Trp Glu Arg
Ser Trp Arg Glu
Ser Trp Val Trp
C30H36N6O6 (576.2696195999999)
Ser Trp Trp Val
C30H36N6O6 (576.2696195999999)
Thr Asp Arg Trp
Thr Asp Trp Arg
Thr Phe Phe Tyr
Thr Phe Tyr Phe
Thr Arg Asp Trp
Thr Arg Trp Asp
Thr Trp Asp Arg
Thr Trp Arg Asp
Thr Tyr Phe Phe
Val Ser Trp Trp
C30H36N6O6 (576.2696195999999)
Val Trp Ser Trp
C30H36N6O6 (576.2696195999999)
Val Trp Trp Ser
C30H36N6O6 (576.2696195999999)
Trp Cys Ile Arg
Trp Cys Leu Arg
Trp Cys Arg Ile
Trp Cys Arg Leu
Trp Asp Glu Lys
Trp Asp Lys Glu
Trp Asp Arg Thr
Trp Asp Thr Arg
Trp Glu Asp Lys
Trp Glu Lys Asp
Trp Glu Arg Ser
Trp Glu Ser Arg
Trp Phe Pro Gln
C30H36N6O6 (576.2696195999999)
Trp Phe Gln Pro
C30H36N6O6 (576.2696195999999)
Trp Ile Cys Arg
Trp Ile Met Gln
Trp Ile Gln Met
Trp Ile Arg Cys
Trp Lys Asp Glu
Trp Lys Glu Asp
Trp Leu Cys Arg
Trp Leu Met Gln
Trp Leu Gln Met
Trp Leu Arg Cys
Trp Met Ile Gln
Trp Met Leu Gln
Trp Met Gln Ile
Trp Met Gln Leu
Trp Pro Phe Gln
C30H36N6O6 (576.2696195999999)
Trp Pro Gln Phe
C30H36N6O6 (576.2696195999999)
Trp Gln Phe Pro
C30H36N6O6 (576.2696195999999)
Trp Gln Ile Met
Trp Gln Leu Met
Trp Gln Met Ile
Trp Gln Met Leu
Trp Gln Pro Phe
C30H36N6O6 (576.2696195999999)
Trp Arg Cys Ile
Trp Arg Cys Leu
Trp Arg Asp Thr
Trp Arg Glu Ser
Trp Arg Ile Cys
Trp Arg Leu Cys
Trp Arg Ser Glu
Trp Arg Thr Asp
Trp Ser Glu Arg
Trp Ser Arg Glu
Trp Ser Val Trp
C30H36N6O6 (576.2696195999999)
Trp Ser Trp Val
C30H36N6O6 (576.2696195999999)
Trp Thr Asp Arg
Trp Thr Arg Asp
Trp Val Ser Trp
C30H36N6O6 (576.2696195999999)
Trp Val Trp Ser
C30H36N6O6 (576.2696195999999)
Trp Trp Ser Val
C30H36N6O6 (576.2696195999999)
Trp Trp Val Ser
C30H36N6O6 (576.2696195999999)
Tyr Phe Phe Thr
Tyr Phe Thr Phe
Tyr Thr Phe Phe
POLY[4,4-METHYLENEBIS(PHENYL ISOCYANATE)-ALT-1,4-BUTANEDIOL/POLY(BUTYLENE ADIPATE)]
cyclooctane,(E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one,ruthenium
C30H50O4Ru (576.2752300000001)
Bafetinib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors
Albuterol sulfate
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent > C319 - Bronchodilator C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D012102 - Reproductive Control Agents > D015149 - Tocolytic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
[(2R,3R,4S,5R,6R)-2-[[(3S,4R,5R,8S,9S,10S,13R,14S,17R)-17-ethenyl-3-hydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate
(4Z,10Z,14E)-8,12-bis(2-carboxyethyl)-3,7,13,18-tetramethyl-1,2,17-trivinyl-23,24-dihydrobilin
(5S,6R,9R)-5-methoxy-N-(2-methoxyphenyl)-3,6,9-trimethyl-2-oxo-14-(pyrazine-2-carbonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
C30H36N6O6 (576.2696195999999)
N-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2R,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
[(3S)-2-[(S)-tert-butylsulfinyl]-3-(2-hydroxyethyl)-4-[3-(2-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]-(4-methyl-1-piperazinyl)methanone
N-[(3R,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide
N-[(2R,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclopropanecarboxamide
N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
N-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
(5S,6R,9R)-5-methoxy-14-[(4-methoxyphenyl)sulfonylamino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
[(3R)-2-[(R)-tert-butylsulfinyl]-3-(2-hydroxyethyl)-4-[3-(2-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]-(4-methyl-1-piperazinyl)methanone
[(3R)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]-(4-methyl-1-piperazinyl)methanone
(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-[[(3R,5R,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-sulfooxyoxane-2-carboxylic acid
[1-[(3E,6E,9E)-dodeca-3,6,9-trienoyl]oxy-3-phosphonooxypropan-2-yl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
ethyl (3s)-3-(acetyloxy)-3-[(1r,2r,5r,6r,7r,8s,10s,11s,14s)-11-(furan-3-yl)-8-hydroxy-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.0¹,¹⁴.0²,⁷]pentadecan-6-yl]propanoate
methyl 4-[(1s,2s,17s,19r)-12-hydroxy-8,8,21,21-tetramethyl-5-(3-methylbut-2-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4,6(11),9,12-tetraen-19-yl]-2-methylbut-2-enoate
1,3,9-tris(acetyloxy)-10-hydroxy-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 3-methylbutanoate
(1s,3r,5r,6as,7s,8s,9r,10r,10as)-1,3,9-tris(acetyloxy)-10-hydroxy-7,8-dimethyl-7-(3-methylpenta-2,4-dien-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-5-yl 3-methylbutanoate
1,12-dihydroxy-9,9,14,18-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-5-oxo-4,8,20-trioxahexacyclo[11.10.0.0³,⁷.0³,¹⁰.0¹⁴,²¹.0¹⁷,²¹]tricosan-15-yl acetate
9-{2-hydroxy-3-[(8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl)oxy]-3-methylbutoxy}-4-methoxyfuro[3,2-g]chromen-7-one
(1s,2s,17s,19r)-12-hydroxy-19-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-17-methoxy-8,8,21,21-tetramethyl-5-(3-methylbut-2-en-1-yl)-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4,6(11),9,12,15-pentaene-14,18-dione
(2e)-4-[(1r,2r,15s,16r,17r,19s)-12-hydroxy-16-methoxy-8,8,21,21-tetramethyl-5-(3-methylbut-2-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4,6(11),9,12-tetraen-19-yl]-2-methylbut-2-enal
(4as,6r,8as)-4,8a-dimethyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-1,4a,5,6,7,8-hexahydronaphthalen-2-one
(8s,21s)-16,27-dimethoxy-7,22-dimethyl-14,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.2¹⁰,¹³.1⁴,³⁰.1¹⁵,¹⁹.0³,⁸.0²⁵,³³.0²⁸,³²]heptatriaconta-1(30),2,4(34),10,12,15(35),16,18,25,27,32,36-dodecaene
(8s)-16,27-dimethoxy-7,22-dimethyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.1⁴,³⁰.1¹⁰,¹⁴.1¹⁵,¹⁹.0³,⁸.0²⁵,³³.0²⁸,³²]hexatriaconta-1(30),2,4(34),10,12,14(36),15(35),16,18,25,27,32-dodecaen-13-ol
(3e,5s)-3-[(2e,4e,6e)-1-hydroxy-7-[(1s,6s)-6-[(1e,3e,5e)-7-hydroxy-7-[(3e,5s)-5-(hydroxymethyl)-1-methyl-2,4-dioxopyrrolidin-3-ylidene]hepta-1,3,5-trien-1-yl]cyclohex-2-en-1-yl]hepta-2,4,6-trien-1-ylidene]-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione
12-hydroxy-16-methyl-15-(6-oxopyran-3-yl)-8-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-oxapentacyclo[9.7.0.0²,⁸.0⁵,⁷.0¹²,¹⁶]octadecane-2-carbaldehyde
(4ar,6r,8ar)-4,8a-dimethyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-1,4a,5,6,7,8-hexahydronaphthalen-2-one
15-Oxokaura-16-ene-2,3,6,7,11-pentaol pentaacetate
{"Ingredient_id": "HBIN001717","Ingredient_name": "15-Oxokaura-16-ene-2,3,6,7,11-pentaol pentaacetate","Alias": "NA","Ingredient_formula": "C30H40O11","Ingredient_Smile": "CC(=O)OC1CC2CC3(C1C4(CC(C(C(C4C(C3OC(=O)C)OC(=O)C)(C)C)OC(=O)C)OC(=O)C)C)C(=O)C2=C","Ingredient_weight": "576.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "458","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101421772","DrugBank_id": "NA"}
atractyloside i
{"Ingredient_id": "HBIN017309","Ingredient_name": "atractyloside i","Alias": "NA","Ingredient_formula": "C27H44O13","Ingredient_Smile": "CC1=C(C(=O)CC2(C1CC(CC2)C(C)(C)OC3C(C(C(C(O3)CO)O)O)O)C)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "576.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14425","TCMID_id": "1981","TCMSP_id": "NA","TCM_ID_id": "6485","PubChem_id": "101831407","DrugBank_id": "NA"}