1254-03-1 (7,12-二羟基-4-胆甾烯-3-酮,7a,12a-Dihydroxycholest-4-en-3-one)

快速询单

结构式：

7,12-二羟基-4-胆甾烯-3-酮MOL文件

CAS号：

1254-03-1

中文名称：

7,12-二羟基-4-胆甾烯-3-酮

英文名称：

7a,12a-Dihydroxycholest-4-en-3-one

分子式：

C₂₇H₄₄O₃

分子量：

416.636468887329

7,12-二羟基-4-胆甾烯-3-酮(1254-03-1)名称与标识符

名称

中文别名：

7,12-二羟基-4-胆甾烯-3-酮;

英文别名：

Cholest-4-en-3-one,7,12-dihydroxy-, (7a,12a)-;7α,12α-Dihydroxycholest-4-en-3-one;7 alpha,12 alpha-dihydroxy-5-cholesten-3-one;(7R,8R,9S,10R,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;7A,12A-DIHYDROXYCHOLEST-4-EN-3-ONE;4-cholesten-7alpha,12alpha-diol-3-one;7,12-Dihydroxycholest-4-en-3-one;7alpha,12alpha-dihydroxy-4-cholesten-3-one;7alpha,12alpha-Dihydroxycholest-4-en-3-one;CPD-7237;7?,12?-Dihydroxycholest-4-en-3-one;7a,12a-dihydroxy-4-cholesten-3-one;Cholest-4-en-3-one, 7,12-dihydroxy-, (7alpha,12alpha)-;LMST04030114;1254-03-1;C17339;SCHEMBL2105777;Q27103727;DTXSID80925121;7alpha,12alpha-Dihydroxy-5-cholesten-3-one;CHEBI:28477;

标识符

InChIKey：

UQPYXHJTHPHOMM-NIBOIBLTSA-N

Inchi：

1S/C27H44O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h13,16-17,20-25,29-30H,6-12,14-15H2,1-5H3/t17-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1

SMILES：

O[C@H]1C[C@@H]2[C@@]3(C)CCC(C=C3C[C@H]([C@H]2[C@@H]2CC[C@H]([C@H](C)CCCC(C)C)[C@]21C)O)=O