87453-36-9 (兰西油酸甲酯,lansiolic-acid,methylester)

快速询单

结构式：

兰西油酸甲酯MOL文件

CAS号：

87453-36-9

中文名称：

兰西油酸甲酯

英文名称：

lansiolic-acid,methylester

分子式：

C₃₁H₅₀O₃

分子量：

470.726910114288

植物源：

龙宫果

兰西油酸甲酯(87453-36-9)名称与标识符

名称

英文别名：

lansiolic-acid,methylester;methyl lansiolate;CHEMBL4209938;methyl 3-[(1S,2S,6S)-2-{2-[(1S,4aR,6S,8aR)-6-hydroxy-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]ethyl}-1,3-dimethyl-6-(prop-1-en-2-yl)cyclohex-3-en-1-yl]propanoate;methyl 3-[(1S,2S,6S)-2-[2-[(1S,4aR,6S,8aR)-6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-1,3-dimethyl-6-prop-1-en-2-ylcyclohex-3-en-1-yl]propanoate;DTXSID101099144;CHEBI:67484;87453-36-9;Methyl (1S,2S,6S)-2-[2-[(1S,4aR,6S,8aR)-decahydro-6-hydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethyl]-1,3-dimethyl-6-(1-methylethenyl)-3-cyclohexene-1-propanoate;Q27135953;

标识符

InChIKey：

UCRMFRXIRGKEPT-NGVCODNXSA-N

Inchi：

1S/C31H50O3/c1-20(2)23-12-10-21(3)24(30(23,7)19-17-28(33)34-9)13-14-25-22(4)11-15-26-29(5,6)27(32)16-18-31(25,26)8/h10,23-27,32H,1,4,11-19H2,2-3,5-9H3/t23-,24-,25-,26-,27-,30-,31+/m0/s1

SMILES：

O[C@H]1CC[C@]2(C)[C@H](C(=C)CC[C@H]2C1(C)C)CC[C@H]1C(C)=CC[C@@H](C(=C)C)[C@]1(C)CCC(=O)OC