Chem
J-GLOBAL ID：200907018123863492
Nikkaji number：J1.136.924C
(8S)-4-Hydroxy-6-(1H-indole-2-ylcarbonyl)-8β-methyl-3,6,7,8-tetrahydrobenzo[1,2-b:4,3-b′]dipyrrole-2-carboxylic acid methyl ester
メチル (8S)-4-ヒドロキシ-6-(1H-インドール-2-カルボニル)-8-メチル-3H,6H,7H,8H-ピロロ[3,2-e]インドール-2-カルボキシラート
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： C22H19N3O4
Molecular formula furigana： C22-H19-N3-O4
Molecular weight： 389.411
InChI：
InChI=1S/C22H19N3O4/c1-11-10-25(21(27)15-7-12-5-3-4-6-14(12)23-15)17-9-18(26)20-13(19(11)17)8-16(24-20)22(28)29-2/h3-9,11,23-24,26H,10H2,1-2H3/t11-/m1/s1
InChI key：
SVXVQSGKGYZESS-LLVKDONJSA-N
SMILES：
COC(=O)c1cc2c3[C@H](C)CN(C(=O)c4cc5ccccc5[nH]4)c3cc(O)c2[nH]1
Systematic name (3)：
- (8S)-4-ヒドロキシ-6-(1H-インドール-2-イルカルボニル)-8β-メチル-3,6,7,8-テトラヒドロベンゾ[1,2-b:4,3-b′]ジピロール-2-カルボン酸メチル
- メチル (8S)-4-ヒドロキシ-6-(1H-インドール-2-カルボニル)-8-メチル-3H,6H,7H,8H-ピロロ[3,2-e]インドール-2-カルボキシラート
- methyl (8S)-4-hydroxy-6-(1H-indole-2-carbonyl)-8-methyl-3H,6H,7H,8H-pyrrolo[3,2-e]indole-2-carboxylate
- (8S)-4-Hydroxy-6-(1H-indole-2-ylcarbonyl)-8β-methyl-3,6,7,8-tetrahydrobenzo[1,2-b:4,3-b′]dipyrrole-2-carboxylic acid methyl ester
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