Chem
J-GLOBAL ID:200907005499482061
Nikkaji number:J9.551F
(+)-Chimonanthine
(+)-キモナンチン
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Substance type:
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
Molecular formula:
C22 H26 N4
Molecular formula furigana:
C22-H26-N4
Molecular weight:
346.478
InChI:
InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21+,22+/m0/s1
InChI key:
HOYXPMHLHJOGHD-FNAHDJPLSA-N
SMILES:
CN1CC[C@@]2([C@H]1Nc1ccccc21)[C@@]12CCN(C)[C@@H]1Nc1ccccc21
Systematic name (4):
3a,3′a-ビ[(3aS,8aS)-1-メチル-1,2,3,3a,8,8a-ヘキサヒドロピロロ[2,3-b]インドール]
(3aS,3′aS,8aS,8′aS)-3a,3′a-ビ[1-メチル-1,2,3,3a,8,8a-ヘキサヒドロピロロ[2,3-b]インドール]
(3aS,8aS)-3a-[(3aS,8aS)-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール-3a-イル]-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール
(3aS,8aS)-3a-[(3aS,8aS)-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-3a-yl]-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indole
Other name (8):
キモナンチン
1-デメチルカリカンチジン
Chimonanthine
1-Demethylcalycanthidine
3a,3′a-Bi[(3aS,8aS)-1-methyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole]
(+)-キモナンチン
(3aS,3′aS,8aS,8′aS)-3a,3′a-Bi[1-methyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole]
(+)-Chimonanthine
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CAS registry number:
5545-89-1
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