Exact Mass: 426.185
Exact Mass Matches: 426.185
Found 500 metabolites which its exact mass value is equals to given mass value 426.185
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Cariprazine
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics Cariprazine is a novel antipsychotic agent candidate that exhibits high affinity for the D3 (Ki=0.085 nM) and D2 (Ki=0.49 nM) receptors, and moderate affinity for the 5-HT1A receptor (Ki=2.6 nM).
(Z)-Narceine imide
(Z)-Narceine imide is an alkaloid from Papaver somniferum (opium poppy
11,13-Dihydrotaraxinic acid glucosyl ester
Constituent of Taraxacum officinale (dandelion). 11,13-Dihydrotaraxinic acid glucosyl ester is found in many foods, some of which are tea, alcoholic beverages, coffee and coffee products, and dandelion. 11,13-Dihydrotaraxinic acid glucosyl ester is found in alcoholic beverages. 11,13-Dihydrotaraxinic acid glucosyl ester is a constituent of Taraxacum officinale (dandelion)
(2,3-Dihydro-5-methyl-3-((4-morpholinyl)methyl)pyrrolo-(1,2,3-de)-1,4-benzoxazin-6-yl)(1-naphthalenyl)methanone monomethanesulfonate
Gemfibrozil 1-O-beta-Glucuronide
Descarboxyethoxyloratadine
Iloperidone
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics Iloperidone (HP 873) is a D2/5-HT2 receptor antagonist. Iloperidone is an atypical antipsychotic for the schizophrenia symptoms[1][2].
Mespirenone
Praeruptorin B
Ripisartan
anomalin
(-)-Praeruptorin B is a natural product found in Angelica cartilaginomarginata, Angelica anomala, and other organisms with data available. Praeruptorin B is a natural product found in Saposhnikovia divaricata with data available. (-)-Anomalin ((-)-Praeruptorin B) is a coumarin derivative isolated from the root of Angelica anomala[1]. (-)-Anomalin ((-)-Praeruptorin B) is a coumarin derivative isolated from the root of Angelica anomala[1]. (-)-Anomalin ((-)-Praeruptorin B) is a coumarin derivative isolated from the root of Angelica anomala[1]. (-)-Anomalin ((-)-Praeruptorin B) is a coumarin derivative isolated from the root of Angelica anomala[1]. Praeruptorin B is an inhibitor of sterol regulatory element-binding proteins (SREBPs). Praeruptorin B is an inhibitor of sterol regulatory element-binding proteins (SREBPs). Praeruptorin B is an inhibitor of sterol regulatory element-binding proteins (SREBPs).
Sonchuside E
2-(1-Hydroxy-1-methylethyl)-4,8-dihydroxy-6-(3-methyl-2-butenyl)-7-methoxy-2,3-dihydro-5H-furo[3,2-b]xanthene-5-one
Ponganone VIII
α-D-Glucopyranosyl 3-O-(2-methylbutanoyl)-α-D-glucopyranoside
(5-methyl-3-(morpholinomethyl)-2,3-dihydro-[1,4]oxazino[2,3,4-hi]indol-6-yl)(naphthalen-1-yl)methanone
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D002491 - Central Nervous System Agents > D000700 - Analgesics D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators
calypteryxin|Peuformosin|Peuformosin; 3-Angeloyloxy-4-senecioyloxy-3,4-dihydro-seselin
2-hydroxy-3,4,45-tetramethoxy-5,6-(2,2-dimethylpyrano)chalcone
3-O-beta-D-glucopyranosyl-3beta,14-dihydroxycostunolide
11beta,13-dihydrolactucin-8-O-p-methoxyphenylacetate|11betaH,13-dihydrolactucin-8-O-p-methoxyphenylacetate
7beta-O-beta-glucopyranosyl bombaxone|7beta-O-beta-glucopyranosyl-10beta-hydroxy hibiscone B
16,19-Secostrychnidine-10,16-dione, 21,22-epoxy-21,22-dihydro-14-hydroxy-4-methoxy-19-methyl-, (21.alpha.,22.alpha.)-
(5c)|21,22alpha-epoxy-4-hydroxy-3-methoxy-19-methyl-(21alpha)-21,22-dihydro-16,19-seco-strychnidine-10,16-dione
(6aS)-3-[(1S*,2S*,4R*)-4-hydroxy-2-methyl-6-oxocyclohexyl]-6aH-furo[2,3-h]isochromene-6,8-dione|multiformin D
4-angeloyloxy-3-senecioyloxy-(-)-trans-khellactone
10beta,14-dihydroxy-10(14),11beta(13)-tetrahydro-8,9-didehydro-3-deoxyzaluzanin C-10-O-beta-glucopyranoside
8beta-hydroxy-4alpha,15-dihydrozaluzanin C-3-O-beta-glucopyranoside
1,3,6-trihydroxy-8-(7-hydroxy-3,7-dimethyl-2,5-octadieyl)-7-methoxyxanthone
(1R,5R,6R,7S,9R)-6,9alpha-epoxy-9,15-bisabolanolide-5-O-beta-D-glucopyranoside|abiespiroside A
(3S)-3-hydroxyatractylenolide III 3-O-beta-D-glucopyranoside|(3S)-3-Hydroxyatractylenolide III 3-O-??-D-glucopyranoside|(3S,5R,8R,10R)-3,8-dihydroxyeudesma-4(15),7(11)-diene-8,12-olide 3-O-beta-D-glucopyranoside
cynarascoloside C|isoamberboin 8-O-beta-D-glucopyranoside
1,4-dihydroxy-3-[4-hydroxyphenyl-(4-hydroxy-3-methoxybenzyl)]-2-(3,5-dihydroxyphenyl)butane|pouzolignan B
4alpha-O-beta-D-glucopyranosyl-15-hydroxyl-5alpha,6betaH-guaiane-10(14),11(13)-dien-12,6alpha-olide
6-O-beta-D-glucopyranosyl-1-O-(2-methylbutanoyl)-beta-D-glucopyranose|nonioside N
methyl (1S,4aS,5aS,14aR)-4a,5,5a,6,11,12,14,14a-Octahydro-8,9-dimethoxy-1-methyl-11-oxo-1H-pyrano[3,4:6,7]indolizino[1,2-b]quinoline-4-carboxylate|ochroborine A
13,17-epoxy-1beta,11beta,12alpha,14beta,15beta-pentahydroxy-2alpha-methoxypicras-3-en-16-one|bruceine M
2-(3,4-Dimethoxyphenyl)-3,5-dimethoxy-7-(prenyloxy)-4H-1-benzopyran-4-one
6-O-beta-D-glucopyranosyl-1-O-(2-methylpropanoyl)-beta-D-glucopyranose|nonioside Q
2-Hexanoyl-1,3,6,8-tetramethoxy-9,10-anthraquinone
3-methylbutanoyl-6-O-alpha-D-glucopyranosyl-beta-D-fructofuranoside|3-Methylbutanoyl-6-O-??-D-glucopyranosyl-??-D-fructofuranosideand
11,13-dihydro-taraxinic acid 14-O-beta-D-glucoside|11,13-Dihydro-Taraxinsaeure-1-O-beta-D-Glucopyranosid|11,13-dihydrotaraxinic acid-beta-glucopyranosyl ester|11beta,13-dihydrotaraxinic acid beta-glucopyranosyl ester|11??,13-Dihydro-taraxinic acid-1-O-??-D-glucopyranoside
1(10)E-4Z-3alpha-hydroxy-germacra-1(10),4,11(13)-trien-6,12-olide-14-O-beta-D-glucopyranoside
11beta,13-dihydrodesacylcynaropicrin 8-beta-D-glucoside|11beta,13-dihydrodesacylcynaropicrin-8-beta-D-glucoside|11betaH-11,13-dihydrodesacylcynaropicrin 8-beta-D-glucoside|3beta-hydroxy-11beta,13-dihydro-8alpha-O-beta-D-glucozaluzanin C
(2R,3R)-pterosin L 3-O-beta-D-glucopyranoside|2R,3R-pterosin L 3-O-beta-D-glucopyranoside
1-oxo-6beta-cinnamoyloxy-1,10-dihydro-secomacrotolide
15-glucopyranosyloxy-2-oxo-guai-3-en-1alpha,5alpha,6beta,7a,10alpha,11betaH-12,6-olide
1,3,6-trihydroxy-8-(6,7-epoxy-3,7-dimethyl-2-octenyl)-7-methoxyxanthone
4alpha-hydroxy-5alpha,8betaH-lindan-7(11)-en-8alpha,12-olide-15-O-beta-D-glucopyranoside|sarcaglaboside G
1,3,6-Trihydroxy-2-(2-hydroxy-3-methyl-3-butenyl)-5-methoxy-7-(3-methyl-2-butenyl)xanthone
(+)-tephrorin A|(2S)-8-[(2S,3R,4S)-4-(acetyloxy)tetrahydro-2-hydroxy-5,5-dimethyl-3-furanyl]-2,3-dihydro-7-methoxy-2-phenyl-4H-1-benzopyran-4-one
3,4,7,8-tetrmethoxy-5,6-(2,2-dimethylpyrano)flavone
ABA-GE cpd
(+)-abscisic acid beta-D-glucopyranosyl ester is a (+)-abscisic acid D-glucopyranosyl ester that is derived from beta-D-glucopyranose. It is functionally related to a (+)-abscisic acid and a beta-D-glucose. (+)-abscisic acid beta-D-glucopyranosyl ester is a natural product found in Salacia chinensis, Arabidopsis thaliana, and other organisms with data available. D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids
[8-[2-(3-methylbut-2-enoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate
[5-formyl-4,8-dihydroxy-3-(3-methoxy-3-oxoprop-1-en-2-yl)-8a-methyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalen-2-yl] 3,4-dihydroxy-2-methylidenebutanoate
[8,8-dimethyl-9-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbut-2-enoate
C21H30O9_Azuleno[4,5-b]furan-2(3H)-one, 8-(beta-D-glucopyranosyloxy)decahydro-6-hydroxy-6-methyl-3,9-bis(methylene)-, (3aS,6R,6aR,8S,9aR,9bS)
C17H30O12_alpha-D-Glucopyranoside, alpha-D-glucopyranosyl, 3-(2-methylbutanoate)
C17H30O12_alpha-D-Glucopyranoside, alpha-D-glucopyranosyl, 2-(2-methylbutanoate)
[8,8-dimethyl-9-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbut-2-enoate
[5-formyl-4,8-dihydroxy-3-(3-methoxy-3-oxoprop-1-en-2-yl)-8a-methyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalen-2-yl] 3,4-dihydroxy-2-methylidenebutanoate
[8-[2-(3-methylbut-2-enoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate [IIN-based: Match]
[8,8-dimethyl-9-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbut-2-enoate [IIN-based on: CCMSLIB00000846416]
[8-[2-(3-methylbut-2-enoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate [IIN-based on: CCMSLIB00000845537]
[8-[2-(3-methylbut-2-enoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate [IIN-based on: CCMSLIB00000845540]
[8,8-dimethyl-9-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbut-2-enoate [IIN-based: Match]
[5-formyl-4,8-dihydroxy-3-(3-methoxy-3-oxoprop-1-en-2-yl)-8a-methyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalen-2-yl] 3,4-dihydroxy-2-methylidenebutanoate_major
[8,8-dimethyl-9-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbut-2-enoate_major
Ala Ala Glu His
Ala Ala His Glu
Ala Cys His Pro
Ala Cys Pro His
Ala Glu Ala His
Ala Glu His Ala
Ala His Ala Glu
Ala His Cys Pro
Ala His Glu Ala
Ala His Pro Cys
Ala Pro Cys His
Ala Pro His Cys
Ala Ser Ser Tyr
Ala Ser Tyr Ser
Ala Tyr Ser Ser
Cys Ala His Pro
Cys Ala Pro His
Cys His Ala Pro
Cys His Pro Ala
Cys Pro Ala His
Cys Pro His Ala
Asp Gly His Val
Asp Gly Val His
Asp His Gly Val
Asp His Val Gly
Asp Val Gly His
Asp Val His Gly
Glu Ala Ala His
Glu Ala His Ala
Glu His Ala Ala
Phe Phe Gly Gly
Phe Gly Gly Phe
Phe Ser Ser Ser
Gly Asp His Val
Gly Asp Val His
Gly Phe Phe Gly
Gly Phe Gly Phe
Gly Gly Phe Phe
Gly His Asp Val
Gly His Val Asp
Gly Ser Thr Tyr
Gly Ser Tyr Thr
Gly Thr Ser Tyr
Gly Thr Tyr Ser
Gly Val Asp His
Gly Val His Asp
Gly Tyr Ser Thr
Gly Tyr Thr Ser
His Ala Ala Glu
His Ala Cys Pro
His Ala Glu Ala
His Ala Pro Cys
His Cys Ala Pro
His Cys Pro Ala
His Asp Gly Val
His Asp Val Gly
His Glu Ala Ala
His Gly Asp Val
His Gly Val Asp
His Pro Ala Cys
His Pro Cys Ala
His Pro Ser Ser
His Ser Pro Ser
His Ser Ser Pro
His Val Asp Gly
His Val Gly Asp
Pro Ala Cys His
Pro Ala His Cys
Pro Cys Ala His
Pro Cys His Ala
Pro His Ala Cys
Pro His Cys Ala
Pro His Ser Ser
Pro Ser His Ser
Pro Ser Ser His
Ser Ala Ser Tyr
Ser Ala Tyr Ser
Ser Phe Ser Ser
Ser Gly Thr Tyr
Ser Gly Tyr Thr
Ser His Pro Ser
Ser His Ser Pro
Ser Pro His Ser
Ser Pro Ser His
Ser Ser Ala Tyr
Ser Ser Phe Ser
Ser Ser His Pro
Ser Ser Pro His
Ser Ser Ser Phe
Ser Ser Tyr Ala
Ser Thr Gly Tyr
Ser Thr Tyr Gly
Ser Tyr Ala Ser
Ser Tyr Gly Thr
Ser Tyr Ser Ala
Ser Tyr Thr Gly
Thr Gly Ser Tyr
Thr Gly Tyr Ser
Thr Ser Gly Tyr
Thr Ser Tyr Gly
Thr Tyr Gly Ser
Thr Tyr Ser Gly
Val Asp Gly His
Val Asp His Gly
Val Gly Asp His
Val Gly His Asp
Val His Asp Gly
Val His Gly Asp
Tyr Ala Ser Ser
Tyr Gly Ser Thr
Tyr Gly Thr Ser
Tyr Ser Ala Ser
Tyr Ser Gly Thr
Tyr Ser Ser Ala
Tyr Ser Thr Gly
Tyr Thr Gly Ser
Tyr Thr Ser Gly
Win 55212-2
A organic heterotricyclic compound that is 5-methyl-3-(morpholin-4-ylmethyl)-2,3-dihydro[1,4]oxazino[2,3,4-hi]indole substituted at position 6 by a 1-naphthylcarbonyl group. D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D002491 - Central Nervous System Agents > D000700 - Analgesics D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators
(+)-Tephrorin A
A monomethoxyflavanone that is (2S)-7-methoxyflavanone substituted at position 8 by a tetrahydrofuran ring which in turn is substituted by geminal methyl groups at position 2, an acetoxy group at position 3 and a hydroxy group at position 5. Isolated from Tephrosia purpurea, it exhibits antineoplastic activity.
Phe Gly Phe Gly
mangostanol
Narceine imide
Edulisin II
11,13-Dihydrotaraxinic acid glucosyl ester
3-QUINOLINAMINE, N-[2-(3,4,5-TRIMETHOXYPHENYL)-1H-PYRROLO[2,3-B]PYRIDIN-4-YL]-
3H-Indolium, 1,3,3-trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl]-, chloride (1:1)
2-acetamido-3-o-benzyl-4,6-o-benzylidene-2-deoxy-beta-d-glucopyranosyl azide
Ripisartan
C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent > C66930 - Angiotensin II Receptor Antagonist
Methanesulfonamide, N-(3-(3-((2,3-dihydro-2-hydroxy-1H-inden-2-yl)methyl)-6-ethyl-3-azabicyclo(3.1.0)hex-6-yl)phenyl)-
Methanone, (2,3-dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo(1,2,3-de)-1,4-benzoxazin-6-yl)-1-naphthalenyl-, (S)-
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D002491 - Central Nervous System Agents > D000700 - Analgesics D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators
4-[2-(3-Hydroxyphenyl)ethyl]-2-[4-[2-(3-hydroxyphenyl)ethyl]phenoxy]phenol
Iloperidone
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics Iloperidone (HP 873) is a D2/5-HT2 receptor antagonist. Iloperidone is an atypical antipsychotic for the schizophrenia symptoms[1][2].
5-methyl-3-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazin-1-yl]propyl]-1H-pyrimidine-2,4-dione
D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists
Prasterone
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone
alpha-D-Glucopyranosyl 2-O-(2-methylbutanoyl)-alpha-D-glucopyranoside
(S)-2-trans-abscisic acid beta-D-glucopyranosyl ester
An (S)-2-trans-abscisic acid D-glucopyranosyl ester derived from beta-D-glucopyranose.
2-[[4-(2-Ethoxyanilino)-6-(4-ethoxyanilino)-2-pyrimidinyl]methylidene]propanedinitrile
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(1-pyrrolidinylsulfonyl)benzamide
6-O-(2-Methylbutanoyl)-alpha-D-glucopyranosyl alpha-D-glucopyranoside
1-O-[(2E,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoyl]-D-glucopyranose
N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5S)-5-Acetamido-1,2,4,6-tetrahydroxyhexan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
2-[(3S,6aS,8R,10aS)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
[(1R,2aR,8bR)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-oxanyl)methanone
2-[(3R,6aR,8R,10aR)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
2-[(3R,6aS,8S,10aS)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
2-[(3S,6aR,8R,10aR)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
[(3aR,4R,9bR)-4-(hydroxymethyl)-8-(2-phenylethynyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone
[(2S,3R)-6-(benzenesulfonyl)-1-(cyclopentylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-2-yl]methanol
[(1S,2aR,8bR)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-oxanyl)methanone
[(1S,2aS,8bS)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-oxanyl)methanone
[(1R,2aS,8bS)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-oxanyl)methanone
2-[(3R,6aS,8R,10aS)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
2-[(3S,6aS,8S,10aS)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
2-[(3S,6aR,8S,10aR)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-(1-oxopropyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3,5-difluorophenyl)methyl]acetamide
[(2S,3S)-6-(benzenesulfonyl)-1-(cyclopentylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-2-yl]methanol
[(2R,3R)-6-(benzenesulfonyl)-1-(cyclopentylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-2-yl]methanol
(S)-2-trans-abscisic acid D-glucopyranosyl ester
A carboxylic ester that results from the condensation of the carboxylic acid group of (S)-2-trans-abscisic acid with the anomeric hydroxy group of D-glucopyranose.
N-[(3R,4R,5S,6R)-2-[(2R,3R,4R,5S)-5-Acetamido-2,3,4,6-tetrahydroxyhexoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
1-[2-(cyclohexen-1-yl)ethyl]-5-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-1,3-diazinane-2,4,6-trione
2-trans-abscisic acid D-glucosyl ester
An enoate ester that results from the condensation of the carboxylic acid group of 2-trans-abscisic acid with the anomeric hydroxy group of D-glucopyranose.
Etrumadenant
Etrumadenant (AB928) is an orally bioavailable, selective dual adenosine receptor (A2aR/A2bR) antagonist. Etrumadenant relieves adenosine-mediated immune suppression. Etrumadenant has immunomodulatory and antitumor activities[1][2].
His-[D-2-ME-Trp]-Ala
His-[D-2-ME-Trp]-Ala is a fragment of the growth hormone hexarelin.
3-hydroxy-3-methyl-6,9-dimethylidene-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-2-one
3,10-dimethyl-2-oxo-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carbaldehyde
(2r,3r)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-2,5,7-trimethyl-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h-inden-1-one
(3r,3ar,6ar,8s,9ar,9br)-3-hydroxy-3-methyl-6,9-dimethylidene-8-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-2-one
4-[2-(2-hydroxyphenyl)ethyl]-2-{4-[2-(3-hydroxyphenyl)ethyl]phenoxy}phenol
5a-methyl-3-methylidene-2-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydro-3ah-naphtho[1,2-b]furan-9-carbaldehyde
4-[2-(3-hydroxyphenyl)ethyl]-2-{4-[2-(3-hydroxyphenyl)ethyl]phenoxy}phenol
3-methyl-2-oxo-10-{[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)oxy]methyl}-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carbaldehyde
4-hydroxy-3,6-dimethyl-9-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3h,3ah,4h,5h,7h,9ah,9bh-azuleno[4,5-b]furan-2-one
(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (3s,3as,11as)-3,10-dimethyl-2-oxo-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carboxylate
(3as,5ar,6s,7r,9as,9bs)-7-hydroxy-5a,9-dimethyl-3-methylidene-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3ah,4h,5h,6h,7h,9ah,9bh-naphtho[1,2-b]furan-2-one
(3as,6r,6ar,8s,9ar,9bs)-6-hydroxy-6-methyl-3,9-dimethylidene-8-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-2-one
(2r)-2-[(2s,3s)-8-methyl-3-({[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,5,6,7-hexahydronaphthalen-2-yl]propanoic acid
(2s)-4-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3h-inden-1-one
6-(hydroxymethyl)-3-methyl-9-methylidene-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,3ah,6ah,7h,8h,9ah,9bh-azuleno[4,5-b]furan-2-one
9-hydroxy-9-methyl-3,6-dimethylidene-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-2-one
2,18-dimethyl 17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate
3-methyl-5-(2,6,6-trimethyl-4-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-yl)penta-2,4-dienoic acid
(1r,3r,4s,9s,16s,18s,19r,21s)-16-(hydroxymethyl)-13-methoxy-12,20-dimethyl-11,14-dioxo-5-oxa-8,17,20-triazahexacyclo[15.3.1.0³,¹⁹.0⁴,⁸.0⁹,¹⁸.0¹⁰,¹⁵]henicosa-10(15),12-diene-21-carbonitrile
methyl 3-{1,6-dimethoxy-2-oxo-10'-oxa-5'-azaspiro[indole-3,2'-tricyclo[5.3.1.0⁴,⁸]undecan]-5'-en-6'-yl}but-2-enoate
(3s,3as,9r,11as)-3,10-dimethyl-2-oxo-9-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carbaldehyde
2,18-dimethyl (1s,9s,16s)-16-hydroxy-21-oxo-2,12-diazapentacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸]henicosa-3,5,7,17-tetraene-2,18-dicarboxylate
10β,14-dihydroxy-10(14),11β(13)-tetrahydro-8,9-didehydro-3-deoxyzaluzanin c10-o-β-d-glucopyranoside
{"Ingredient_id": "HBIN000060","Ingredient_name": "10\u03b2,14-dihydroxy-10(14),11\u03b2(13)-tetrahydro-8,9-didehydro-3-deoxyzaluzanin c10-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "CC1C2C=CC(C3CCC(=C)C3C2OC1=O)(CO)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6142","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1(10),4,11(13)-germacratrien-12,6-olid-14-oic acid; (1(10)z,4e,6α)-form,11,13-dihydro,beta-d-glucopyranosyl ester
{"Ingredient_id": "HBIN000218","Ingredient_name": "1(10),4,11(13)-germacratrien-12,6-olid-14-oic acid; (1(10)z,4e,6\u03b1)-form,11,13-dihydro,beta-d-glucopyranosyl ester","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9728","PubChem_id": "NA","DrugBank_id": "NA"}
11β,13-dihydrotaraxinic acid
{"Ingredient_id": "HBIN000361","Ingredient_name": "11\u03b2,13-dihydrotaraxinic acid","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "CC1C2CCC(=CCCC(=CC2OC1=O)C)C(=O)OC3C(C(C(C(O3)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41594","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
11β,13-dihydro-taraxinicacid-1'-o-β-d-glucopyranoside
{"Ingredient_id": "HBIN000362","Ingredient_name": "11\u03b2,13-dihydro-taraxinicacid-1'-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "CC1C2C(CC(=C)C3CC(C(=C)C3C2OC1=O)O)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5723","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
11β,13-dihydrotaraxinic acid β-glucopyranosyl ester
{"Ingredient_id": "HBIN000363","Ingredient_name": "11\u03b2,13-dihydrotaraxinic acid \u03b2-glucopyranosyl ester","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "CC1C2CCC(=CCCC(=CC2OC1=O)C)C(=O)OC3C(C(C(C(O3)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41595","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2r,3r-pterosin l-2'-o-β-d-glucoside
{"Ingredient_id": "HBIN006457","Ingredient_name": "2r,3r-pterosin l-2'-o-\u03b2-d-glucoside","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18126","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2s,3r-pterosin l-2'-o-β-d-glucoside
{"Ingredient_id": "HBIN006686","Ingredient_name": "2s,3r-pterosin l-2'-o-\u03b2-d-glucoside","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18127","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s)-3-hydroxyatractylenolide iii3-o-β-d-glucopyranoside
{"Ingredient_id": "HBIN009613","Ingredient_name": "(3s)-3-hydroxyatractylenolide iii3-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "CC1=C2CC3C(=C)C(CCC3(CC2(OC1=O)O)C)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9805","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
9α-hydroxy-11β,13-dihydrozaluzanin c3-o-β-allopyranoside
{"Ingredient_id": "HBIN014042","Ingredient_name": "9\u03b1-hydroxy-11\u03b2,13-dihydrozaluzanin c3-o-\u03b2-allopyranoside","Alias": "NA","Ingredient_formula": "C21H30O9","Ingredient_Smile": "CC1C2CC(C(=C)C3CC(C(=C)C3C2OC1=O)OC4C(C(C(C(O4)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10011","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}