中文别名
乌心石内酯木香内酯乌心石内酯、木香内酯木香内酯(乌心石内酯)乌心石内酯(木香内酯)乌心石内酯
英文别名
Azuleno[4,5-b]furan-2(3H)-one, 3a,4,5,7,8,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-, [3aS-(3aα,9α,9aα,9bβ)]-(3aS,9R,9aS,9bS)-3a,4,5,7,8,9,9a,9b-Octahydro-9-hydroxy-6,9-dimethyl-3-methyleneazuleno[4,5-b]furan-2(3H)-oneMicheliolide[3aS-(3aalpha,9alpha,9aalpha,9bbeta)]-3a,4,5,7,8,9,9a,9b-Octahydro-9-hydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-oneCS-1321MecheliolideAzuleno[4,5-b]furan-2(3H)-one, 3a,4,5,7,8,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-, (3aS,9R,9aS,9bS)-Micheliolide 68370-47-8Micheliolide, BR
CAS
68370-47-8
Inchi
InChI=1S/C15H20O3/c1-8-4-5-11-9(2)14(16)18-13(11)12-10(8)6-7-15(12,3)17/h11-13,17H,2,4-7H2,1,3H3/t11-,12-,13-,15+/m0/s1
InChIkey
RDJAFOWISVMOJY-PWNZVWSESA-N
Canonical Smiles
CC1=C2CC[C@@]([C@@H]2[C@@H]3[C@@H](CC1)C(=C)C(=O)O3)(C)O
国际化联命名
(3aS,9R,9aS,9bS)-9-hydroxy-6,9-dimethyl-3-methylidene-4,5,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one
密度：1.17
熔点：131-133 oC
沸点：426.1°C at 760 mmHg
折射率：1.555
闪光点：181.8°C
蒸汽压：0.0±2.3 mmHg at 25°C
PSA：46.53000
logP：2.35550
溶解度：微溶 (7.4 g/L) (25 oC),
颜色：Powder
物理属性：类白色粉末，可溶于甲醇、乙醇、DMSO等有机溶剂。
酸度系数（pka）：14.65±0.40(Predicted)
存储温度：Sealed in dry,2-8°C
