362499-07-8 (7α,17α-二甲基-5β-雄甾烷-3α,17β-二醇葡萄糖醛酸苷,7α,17α-dimethyl-5β-androstane-3α,17β-diol glucuronide)

CAS号:
362499-07-8
中文名称:
7α,17α-二甲基-5β-雄甾烷-3α,17β-二醇葡萄糖醛酸苷
英文名称:
7α,17α-dimethyl-5β-androstane-3α,17β-diol glucuronide
分子式:
C27H44O8
分子量:
496.633469581604

7α,17α-二甲基-5β-雄甾烷-3α,17β-二醇葡萄糖醛酸苷(362499-07-8)名称与标识符

标识符

InChIKey:
PCMAVZDVKFXHRU-JAOKJGKVSA-N
Inchi:
1S/C27H44O8/c1-13-11-14-12-15(34-24-21(30)19(28)20(29)22(35-24)23(31)32)5-8-25(14,2)16-6-9-26(3)17(18(13)16)7-10-27(26,4)33/h13-22,24,28-30,33H,5-12H2,1-4H3,(H,31,32)/t13-,14-,15-,16+,17+,18-,19+,20+,21-,22+,24-,25+,26+,27+/m1/s1
SMILES:
[H][C@]12[C@@]3([C@@H](C[C@]4([C@@](C)([C@@]3([H])CC[C@]1(C)[C@](O)(C)CC2)CC[C@@H](O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(=O)O)O1)C4)[H])C)[H]