(+)-(4aR)-(10bR)-4-methyl-8-(1-acetyl-7-nitroindolin-5-yl)-10b-methyl-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinolin-3-one

HCID 54095089

기본 정보

표준 SMILES
CC(=O)N1CCc2cc(-c3ccc4c(c3)CC[C@H]3N(C)C(=O)CC[C@]43C)cc([N+](=O)[O-])c21
InChIKey
MWOJKTFVYNGJSZ-RCZVLFRGSA-N
분자식
C25H27N3O4
평균 분자량
433.5 g/mol

이름 및 식별자

우선 이름
(+)-(4aR)-(10bR)-4-methyl-8-(1-acetyl-7-nitroindolin-5-yl)-10b-methyl-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinolin-3-one
IUPAC
(4aR,10bR)-8-(1-acetyl-7-nitro-2,3-dihydroindol-5-yl)-4,10b-dimethyl-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one

이름 및 동의어

SCHEMBL7465693MWOJKTFVYNGJSZ-RCZVLFRGSA-N(+)-(4aR)-(10bR)-4-methyl-8-(1-acetyl-7-nitroindolin-5--yl)-10b-methyl-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinolin-3one(+)-(4aR)-(10bR)-4-methyl-8-(1-acetyl-7-nitroindolin-5-yl )-10b-methyl-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinolin-3-one(+)-(4aR)-(10bR)-4-methyl-8-(1-acetyl-7-nitroindolin-5-yl)-10b-methyl-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinolin-3-one

데이터베이스 식별자

PubChem CID
54095089

물성

구조 계산 물성

XLogP
3.4
극성 표면적
86.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
32

관련 반응

4건

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