(2R,4aR,10bR)-6-(2,6-Dimethoxy-pyridin-3-yl)-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydro-phenanthridin-2-ol

HCID 11258441CAS 864740-19-2

기본 정보

표준 SMILES
CCOc1cc2c(cc1OC)C(c1ccc(OC)nc1OC)=N[C@@H]1CC[C@@H](O)C[C@H]21
InChIKey
NQMAAFUKIUCXHK-MZMPZRCHSA-N
분자식
C23H28N2O5
평균 분자량
412.5 g/mol
단동위원소 질량
412.199822

이름 및 식별자

우선 이름
(2R,4aR,10bR)-6-(2,6-Dimethoxy-pyridin-3-yl)-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydro-phenanthridin-2-ol
IUPAC
(2R,4aR,10bR)-6-(2,6-dimethoxy-3-pyridinyl)-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol

이름 및 동의어

6C7UKU3FVASCHEMBL1411375NQMAAFUKIUCXHK-MZMPZRCHSA-N(2R,4aR,10bR)-6-(2,6-Dimethoxy-pyridin-3-yl)-9-eth oxy-8-methoxy-1,2,3,4,4a,10b-hexahydro-phenanthridin-2-ol(2R,4aR,10bR)-6-(2,6-Dimethoxy-pyridin-3-yl)-9-ethoxy-8-methoxy-1,2,3,4,4a, 10b-hexahydro-phenanthridin-2-ol(2R,4aR,10bR)-6-(2,6-Dimethoxy-pyridin-3-yl)-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydro-phenanthridin-2-ol(2r,4ar,10br)-6-(2,6-dimethoxy-pyridin-3-yl)-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol2-Phenanthridinol, 6-(2,6-dimethoxy-3-pyridinyl)-9-ethoxy-1,2,3,4,4a,10b-hexahydro-8-methoxy-, (2R,4aR,10bR)-864740-19-2

데이터베이스 식별자

CAS
864740-19-2
PubChem CID
11258441
UNII
6C7UKU3FVA

물성

구조 계산 물성

XLogP
3.2
극성 표면적
82.4 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
6
무거운 원자 수
30

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18건

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