(4aS,6aR,11aR,11bS)-4,4,6a,7,11b-Pentamethyl-2,3,4,4a,5,6,6a,11,11a,11b-decahydro-1H-benzo[a]fluoren-9-ol
(4aS,6aR,11aR,11bS)-4,4,6a,7,11b-Pentamethyl-2,3,4,4a,5,6,6a,11,11a,11b-decahydro-1H-benzo[a]fluoren-9-ol · CAS 1000009-73-3
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (4aS,6aR,11aR,11bS)-4,4,6a,7,11b-Pentamethyl-2,3,4,4a,5,6,6a,11,11a,11b-decahydro-1H-benzo[a]fluoren-9-ol
- CAS
- 1000009-73-3
- CID
- 23634362
- IUPAC 名称
- (4aS,6aR,11aR,11bS)-4,4,6a,7,11b-pentamethyl-1,2,3,4a,5,6,11,11a-octahydrobenzo[a]fluoren-9-ol
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (4aS,6aR,11aR,11bS)-4,4,6a,7,11b-Pentamethyl-2,3,4,4a,5,6,6a,11,11a,11b-decahydro-1H-benzo[a]fluoren-9-ol
- CAS
- 1000009-73-3
- CID
- 23634362
- IUPAC 名称
- (4aS,6aR,11aR,11bS)-4,4,6a,7,11b-pentamethyl-1,2,3,4a,5,6,11,11a-octahydrobenzo[a]fluoren-9-ol
分子属性
- 分子式
- C22H32O
- 分子量
- 312.5 g/mol
- 精确质量
- 312.24531564 Da
- 单同位素质量
- 312.24531564 Da
- XLogP
- 7.2
- 极性表面积
- 20.2 Ų
- 氢键供体
- 1
- 氢键受体
- 1
- 可旋转键
- 0
- 重原子数
- 23
- 净电荷
- 0
- 结构复杂度
- 482
结构标识
- InChIKey
- ZAZRBTKHYPRONZ-GKJHBJHPSA-N
- SMILES
- CC1=CC(=CC2=C1[C@@]3(CC[C@@H]4[C@@]([C@H]3C2)(CCCC4(C)C)C)C)O
- InChI
- InChI=1S/C22H32O/c1-14-11-16(23)12-15-13-18-21(4)9-6-8-20(2,3)17(21)7-10-22(18,5)19(14)15/h11-12,17-18,23H,6-10,13H2,1-5H3/t17-,18+,21-,22+/m0/s1