(4S,5Z,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
(4S,5Z,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one · CAS 108885-62-7
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (4S,5Z,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
- CAS
- 108885-62-7
- CID
- 10658191
- IUPAC 名称
- (4S,5Z,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (4S,5Z,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
- CAS
- 108885-62-7
- CID
- 10658191
- IUPAC 名称
- (4S,5Z,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
分子属性
- 分子式
- C15H20O3
- 分子量
- 248.32 g/mol
- 精确质量
- 248.1412445 Da
- 单同位素质量
- 248.1412445 Da
- XLogP
- 2.4
- 极性表面积
- 46.5 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 1
- 重原子数
- 18
- 净电荷
- 0
- 结构复杂度
- 431
结构标识
- InChIKey
- XJUHTEFWFCFCBI-PMMOVUOPSA-N
- SMILES
- C/C/1=C/C[C@@H]([C@H]2C=C(CC[C@@H]1O)C(=O)O2)C(=C)C
- InChI
- InChI=1S/C15H20O3/c1-9(2)12-6-4-10(3)13(16)7-5-11-8-14(12)18-15(11)17/h4,8,12-14,16H,1,5-7H2,2-3H3/b10-4-/t12-,13+,14-/m1/s1