Chem
J-GLOBAL ID：200907081171882150
Nikkaji number：J1.722.598G
PS-316
(E)-2-メチル-4-[[(3aS)-1-メチル-5-メトキシ-1,2,3,3a,8,8aα-ヘキサヒドロピロロ[2,3-b]インドール]-3aα-イル]-2-ブテン酸メチル
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C18H24N2O3
Molecular formula furigana： C18-H24-N2-O3
Molecular weight： 316.401
InChI：
InChI=1S/C18H24N2O3/c1-12(16(21)23-4)7-8-18-9-10-20(2)17(18)19-15-6-5-13(22-3)11-14(15)18/h5-7,11,17,19H,8-10H2,1-4H3/b12-7+/t17-,18-/m0/s1
InChI key：
AZVZTFHHCZQLHG-FWAGDVOXSA-N
SMILES：
COC(=O)/C(=C/C[C@@]12CCN(C)[C@@H]1Nc1ccc(OC)cc21)/C
Systematic name (3)：
- (E)-2-メチル-4-[[(3aS)-1-メチル-5-メトキシ-1,2,3,3a,8,8aα-ヘキサヒドロピロロ[2,3-b]インドール]-3aα-イル]-2-ブテン酸メチル
- メチル (2E)-4-[(3aS,8aS)-5-メトキシ-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール-3a-イル]-2-メチルブタ-2-エノアート
- methyl (2E)-4-[(3aS,8aS)-5-methoxy-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-3a-yl]-2-methylbut-2-enoate
- (E)-2-Methyl-4-[[(3aS)-1-methyl-5-methoxy-1,2,3,3a,8,8aα-hexahydropyrrolo[2,3-b]indole]-3aα-yl]-2-butenoic acid methyl ester
- PS-316
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