John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8p32OnO8I9N

(accessed ).
[3,4-(13)C(2)]-3-OXO-CHOLA-4,6-DIEN-24-OIC-ACID-METHYLESTER
SpectraBase Compound ID 8p32OnO8I9N
InChI InChI=1S/C25H36O3/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/h6-7,15-16,19-22H,5,8-14H2,1-4H3/t16-,19-,20+,21-,22-,24-,25+/m0/s1/i15+1,18+1
InChIKey OSRBYFQAFFCYCV-CDWHCZGHSA-N
Mol Weight 386.5 g/mol
Molecular Formula C2313C2H36O3
Exact Mass 386.273155 g/mol
Enantiomer InChIKey OSRBYFQAFFCYCV-YNYPISKUSA-N
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