56221-98-8 (柔毛地胆宁,2-Butenoic acid,2-methyl-,(3aR,4S,6E,9Z,11S,11aS)-2,3,3a,4,5,8,11,11a-octahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,8-dioxocyclodeca[b]furan-4-ylester, (2E)-)

快速询单

结构式：

柔毛地胆宁MOL文件

CAS号：

56221-98-8

中文名称：

柔毛地胆宁

英文名称：

2-Butenoic acid,2-methyl-,(3aR,4S,6E,9Z,11S,11aS)-2,3,3a,4,5,8,11,11a-octahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,8-dioxocyclodeca[b]furan-4-ylester, (2E)-

分子式：

C₂₀H₂₄O₆

分子量：

360.400966644287

柔毛地胆宁(56221-98-8)名称与标识符

名称

中文别名：

柔毛地胆宁;

英文别名：

2-Butenoic acid,2-methyl-,(3aR,4S,6E,9Z,11S,11aS)-2,3,3a,4,5,8,11,11a-octahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,8-dioxocyclodeca[b]furan-4-ylester, (2E)-;2-Butenoic acid,2-methyl-,(3aR,4S,6E,9Z,11S,11aS)-2,3,3a,4,5,8,11,11a-octahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,8-diox;molephantinin;2-Butenoic acid, 2-methyl-, (3aR,4S,6E,9Z,11S,11aS)-2,3,3a,4,5,8,11,11a-octahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,8-dioxocyclodeca[b]furan-4-yl ester, (2E)-;

标识符

InChIKey：

VUURQISRHJCAJY-CXRMMEALSA-N

Inchi：

1S/C20H24O6/c1-6-11(3)19(23)25-15-8-10(2)7-14(21)9-12(4)17(22)18-16(15)13(5)20(24)26-18/h6-7,9,15-18,22H,5,8H2,1-4H3/b10-7+,11-6+,12-9-/t15-,16+,17-,18-/m0/s1

SMILES：

C(O[C@@H]1[C@@]2([H])C(=C)C(=O)O[C@]2([H])[C@@H](O)C(C)=CC(=O)C=C(C)C1)(=O)/C(/C)=C/C |c:16,20|