3-O-Acetyloleanolic acid 3-O-乙酰胆酸

CAS 4339-72-4 MFCD09752429

化学结构图

4339-72-4
SMILES: CC(=O)OC1CCC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(C(=O)O)CCC23C)C1(C)C

化学属性

Mol. FormulaC32H50O4
Mol. Weight498.74
Melting Point265-268 ºC
Density1.10

别名和识别编码

Chemical Name(4aS,6aS,6bR,10S,12aR,12bR,14bR)-10-acetoxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
Synonym 3-O-Acetyloleanolic acid; 3beta-3-Acetoxyolean-12-en-28-oic acid 3-O-acetyloleanolic acid 3-acetyloleanolic acid oleanolic acid 3-acetate
CAS Number4339-72-4
InChIKeyRIXNFYQZWDGQAE-DFHVBEEKSA-N
LabNetwork Molecule IDLN02138539
Chemical Name Translation3-O-乙酰胆酸
PubChem Substance ID151202
InChIInChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(6)23(28(25,4)5)11-14-31(8)24(29)10-9-21-22-19-27(2,3)15-17-32(22,26(34)35)18-16-30(21,31)7/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22-,23-,24+,25-,29-,30+,31+,32-/m0/s1
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