(3S,4aR,4bS,6S,8R,8aR,10aR)-3-Furan-3-yl-4a,8a-dimethyl-1,5-dioxo-6-trimethylsilanyloxy-dodecahydro-2-oxa-phenanthrene-8-carboxylic acid methyl ester

HCID 11167140
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기본 정보

표준 SMILES
COC(=O)[C@@H]1C[C@H](O[Si](C)(C)C)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
InChIKey
BWXMOBMYRUQCGA-WFOQEEKOSA-N
분자식
C24H34O7Si
평균 분자량
462.6 g/mol

이름 및 식별자

우선 이름
(3S,4aR,4bS,6S,8R,8aR,10aR)-3-Furan-3-yl-4a,8a-dimethyl-1,5-dioxo-6-trimethylsilanyloxy-dodecahydro-2-oxa-phenanthrene-8-carboxylic acid methyl ester
IUPAC
methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-6a,10b-dimethyl-4,10-dioxo-9-trimethylsilyloxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate

이름 및 동의어

CHEMBL427337SCHEMBL3539450BWXMOBMYRUQCGA-WFOQEEKOSA-NBDBM50170677(2S,4aR,6aR,7R,9S,10aS,10bR)-9-(trimethylsilanyloxy)-2-(3-furanyl)-dodecahydro-6a,10b-dimethyl-4,10-dioxo-2H-naphtho[2,1-c]pyran-7-carboxylic acid methyl ester(3S,4aR,4bS,6S,8R,8aR,10aR)-3-Furan-3-yl-4a,8a-dimethyl-1,5-dioxo-6-trimethylsilanyloxy-dodecahydro-2-oxa-phenanthrene-8-carboxylic acid methyl ester

데이터베이스 식별자

PubChem CID
11167140
ChEMBL
CHEMBL427337

물성

구조 계산 물성

극성 표면적
92 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
5
무거운 원자 수
32

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