METHYL CHENODEOXYCHOLATE

CAS No.
3057-04-3
CCD No.
CCD00105511
Formula
C25 H42 O4
MolWeight
406.603

Basic Information

Product Name: METHYL CHENODEOXYCHOLATE
CAS: 3057-04-3
English Synonyms: 5BETA-CHOLANIC ACID-3ALPHA,7ALPHA-DIOL METHYL ESTER ; CHENODEOXYCHOLIC ACID METHYL ESTER ; METHYL CHENODEOXYCHOLATE
MDL Number.: MFCD00232923
H bond acceptor: 4
H bond donor: 2
Smile: C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
InChi: InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21-,23+,24+,25-/m1/s1
InChiKey: InChIKey=GRQROVWZGGDYSW-IFJDUOSNSA-N

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