10-Hydroxy-3a,5a-dimethyl-1a,2,3,3a,3b,4,5,5a,7,8,8a,8b,9,10-tetradecahydro-1H,5'H-spiro[cyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalene-6,2'-furan]-5'-one
10-Hydroxy-3a,5a-dimethyl-1a,2,3,3a,3b,4,5,5a,7,8,8a,8b,9,10-tetradecahydro-1H,5'H-spiro[cyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalene-6,2'-furan]-5'-one · CAS 7247-99-6
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- 10-Hydroxy-3a,5a-dimethyl-1a,2,3,3a,3b,4,5,5a,7,8,8a,8b,9,10-tetradecahydro-1H,5'H-spiro[cyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalene-6,2'-furan]-5'-one
- CAS
- 7247-99-6
- CID
- 247857
- IUPAC 名称
- (1'S,2'R,5R,5'S,7'R,8'R,10'R,11'S,15'S)-8'-hydroxy-2',15'-dimethylspiro[furan-5,14'-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecane]-2-one
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- 10-Hydroxy-3a,5a-dimethyl-1a,2,3,3a,3b,4,5,5a,7,8,8a,8b,9,10-tetradecahydro-1H,5'H-spiro[cyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalene-6,2'-furan]-5'-one
- CAS
- 7247-99-6
- CID
- 247857
- IUPAC 名称
- (1'S,2'R,5R,5'S,7'R,8'R,10'R,11'S,15'S)-8'-hydroxy-2',15'-dimethylspiro[furan-5,14'-pentacyclo[8.7.0.02,7.05,7.011,15]heptadecane]-2-one
分子属性
- 分子式
- C22H30O3
- 分子量
- 342.5 g/mol
- 精确质量
- 342.21949481 Da
- 单同位素质量
- 342.21949481 Da
- XLogP
- 4.2
- 极性表面积
- 46.5 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 0
- 重原子数
- 25
- 净电荷
- 0
- 结构复杂度
- 699
结构标识
- InChIKey
- OUBYDRMNFCCAQT-SMGBYZLYSA-N
- SMILES
- C[C@]12CC[C@@H]3[C@@]1(C3)[C@@H](C[C@@H]4[C@@H]2CC[C@]5([C@H]4CC[C@@]56C=CC(=O)O6)C)O
- InChI
- InChI=1S/C22H30O3/c1-19-8-4-16-14(15(19)5-9-21(19)10-6-18(24)25-21)11-17(23)22-12-13(22)3-7-20(16,22)2/h6,10,13-17,23H,3-5,7-9,11-12H2,1-2H3/t13-,14-,15-,16-,17+,19-,20+,21+,22-/m0/s1