Chem
J-GLOBAL ID：200907088662347196
Nikkaji number：J626.624J
12-epi-Hapalindole C
12-epi-ハパリノドールC
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： C20[C-]H24N[N+]
Molecular formula furigana： C21-H24-N2
Molecular weight： 304.437
InChI：
InChI=1S/C21H24N2/c1-6-21(4)12-11-15(14(2)3)19(20(21)22-5)17-13-23-18-10-8-7-9-16(17)18/h6-10,13,15,19-20,23H,1-2,11-12H2,3-4H3/t15-,19+,20-,21-/m1/s1
InChI key：
KGWATBYKCMCFLC-CGRMTHRGSA-N
SMILES：
CC(=C)[C@H]1CC[C@@](C)(C=C)[C@H]([N+]#[C-])[C@@H]1c1c[nH]c2ccccc12
Systematic name (6)：
- 3-[(1S)-2β-イソシアノ-3-メチル-3α-ビニル-6α-(1-メチルエテニル)シクロヘキサン-1β-イル]-1H-インドール
- 3-[(1S)-3α-エテニル-2β-イソシアノ-3-メチル-6α-イソプロペニルシクロヘキサン-1β-イル]-1H-インドール
- 1α-イソシアノ-2α-(1H-インドール-3-イル)-3β-(1-メチルエテニル)6β-ビニル-6-メチルシクロヘキサン
- 3-[(1S)-3α-エテニル-2β-イソシアノ-3-メチル-6α-(1-メチルエテニル)シクロヘキサン-1β-イル]-1H-インドール
- (1S,2R,3S,4S)-1-エテニル-3-(1H-インドール-3-イル)-2-イソシアノ-1-メチル-4-(プロパ-1-エン-2-イル)シクロヘキサン
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- 3-[(1S)-2β-Isocyano-3-methyl-3α-vinyl-6α-(1-methylethenyl)cyclohexan-1β-yl]-1H-indole
- 3-[(1S)-3α-Ethenyl-2β-isocyano-3-methyl-6α-isopropenylcyclohexane-1β-yl]-1H-indole
- 12-epi-ハパリンドールCイソニトリル
- 12-epi-Hapalindole C isonitrile
- 1α-Isocyano-2α-(1H-indole-3-yl)-3β-(1-methylethenyl)6β-vinyl-6-methylcyclohexane
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