135240
Cholic acid
98%
Synonym(s):
3α,7α,12α-Trihydroxy-5β-cholanic acid, Cholanic acid
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About This Item
Assay
98%
optical activity
[α]20/D +35°, c = 0.6 in 95% ethanol
mp
200-201 °C (lit.)
SMILES string
[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@]([H])(CC[C@@]4([H])[C@]3([H])[C@H](O)C2)[C@H](C)CCC(O)=O
InChI
1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1
InChI key
BHQCQFFYRZLCQQ-OELDTZBJSA-N
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