564-16-9 (11-脱氧-18beta-甘草亭酸,11-Deoxo-18beta-glycyrrhetic acid)

快速询单

结构式：

11-脱氧-18beta-甘草亭酸MOL文件

CAS号：

564-16-9

中文名称：

11-脱氧-18beta-甘草亭酸

英文名称：

11-Deoxo-18beta-glycyrrhetic acid

分子式：

C₃₀H₄₈O₃

分子量：

456.700329780579

11-脱氧-18beta-甘草亭酸(564-16-9)名称与标识符

名称

中文别名：

11-脱氧-18beta-甘草亭酸;(3beta,20beta)-3-羟基齐墩果-12-烯-29-酸;11-脱氧甘草次酸;

英文别名：

11-Deoxo-18beta-glycyrrhetic acid;(3beta,20beta)-3-Hydroxy-olean-12-en-29-oic acid;(2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid;11-Deoxoglycyrrhetinic acid;(3beta,18alpha)-3-hydroxyolean-12-en-29-oic acid;11-Deoxoglycyrrhetic acid;(2S,4aS,6aS,6bR,8aR,10S,12aR,12bR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-2-carboxylic acid;(3beta,20beta)-3-hydroxyolean-12-en-29-oic acid;BDBM50346605;11-Deoxyglycyrrhetinic acid;3-Hydroxy-(3beta,20beta)-Olean-12-en-29-oic acid;(2S,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid;Anaphalisoleanenoic acid;CHEBI:168602;CHEMBL487933;11-Deoxo-18beta-glycyrrhetinic acid;11-deoxy glycyrrhetinic acid;11-Desoxoglycyrrhetinsaure;564-16-9;SCHEMBL1785482;Olean-12-en-30-oic acid, 3beta-hydroxy- (8CI);3alpha-hydroxyolean-12-en-30-oic acid;LMPR0106150016;CHEMBL482798;DTXSID40348372;HY-169739;ARD193990;DG 381B;11-DOGA;

标识符

InChIKey：

JZFSMVXQUWRSIW-BTJIZOSBSA-N

Inchi：

1S/C30H48O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,26+,27-,28-,29+,30+/m0/s1

SMILES：

O[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C)CC[C@@](C(=O)O)(C)C[C@H]4C3=CC[C@@H]12