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

(accessed ).
[3,4-(13)C(2)]-DEOXYCHOLIC-ACID
SpectraBase Compound ID DJkjWCHKDUB
InChI InChI=1S/C23H38O4/c1-13(3-8-21(26)27)16-6-7-18-17-5-4-14-11-15(24)9-10-23(14,2)19(17)12-20(25)22(16)18/h13-20,22,24-25H,3-12H2,1-2H3,(H,26,27)/t13-,14+,15+,16+,17-,18-,19-,20-,22+,23-/m0/s1/i11+1,15+1
InChIKey HUPLQBFZDZOXSZ-GETHTCKISA-N
Mol Weight 380.5 g/mol
Molecular Formula C2113C2H38O4
Exact Mass 380.28372 g/mol
Enantiomer InChIKey HUPLQBFZDZOXSZ-QSJGHECKSA-N
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