LITHOCHOLIC ACID METHYL ESTER ,1249-75-8 _ChemCD

LITHOCHOLIC ACID METHYL ESTER

basic_info
Product_Name：	LITHOCHOLIC ACID METHYL ESTER
CAS：	1249-75-8
EnglishSynonyms：	3-ALPHA-HYDROXY-5-BETA-CHOLAN-24-OIC ACID METHYL ESTER ; 5BETA-CHOLANIC ACID-3ALPHA-OL METHYL ESTER ; LITHOCHOLIC ACID METHYL ESTER ; METHYL LITHOCHOLATE ; 5BETA-CHOLAN-24-OIC ACID-3A-OL ; 5BETA-CHOLAN-24-OIC ACID 3ALPHA-OL METHYL ESTER
pro_mdlNumber：	MFCD00046274
pro_acceptors：	3
pro_donors：	1
pro_smile：	C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C
InChi：	InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1
InChiKey：	InChIKey=YXZVCZUDUJEPPK-ULCLHEGSSA-N

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