3ALPHA-ACETOXY-12-OXOLITHOCHOLANIC ACID ,66874-05-3

3ALPHA-ACETOXY-12-OXOLITHOCHOLANIC ACID

Basic Information
Product Name：	3ALPHA-ACETOXY-12-OXOLITHOCHOLANIC ACID
CAS：	66874-05-3
English Synonyms：	3ALPHA-ACETOXY-12-OXOLITHOCHOLANIC ACID
MDL Number.：	MFCD17215560
H bond acceptor：	5
H bond donor：	1
Smile：	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)OC(=O)C)C)C
InChi：	InChI=1S/C26H40O5/c1-15(5-10-24(29)30)20-8-9-21-19-7-6-17-13-18(31-16(2)27)11-12-25(17,3)22(19)14-23(28)26(20,21)4/h15,17-22H,5-14H2,1-4H3,(H,29,30)/t15-,17-,18-,19+,20-,21+,22+,25+,26-/m1/s1
InChiKey：	InChIKey=HZNDGGABZZJKNK-SIKGHVKHSA-N

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