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Nor-Desoxycholic Acid
[CAS# 53608-86-9]

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Identification
Name Nor-Desoxycholic Acid
Synonyms (3R)-3-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-Dihydroxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Butyric Acid; 23-Nor-5Beta-Cholanic Acid, 3Alpha, 12Alpha Diol; 23-Nor-Deoxycholic Acid
Molecular Structure CAS#: 53608-86-9, Nor-Desoxycholic Acid
Molecular Formula C23H38O4
Molecular Weight 378.55
CAS Registry Number 53608-86-9
SMILES [C@@H]3(O)[C@]4([C@H]([C@H]2[C@@H]([C@@]1([C@@H](C[C@@H](CC1)O)CC2)C)C3)CC[C@@H]4[C@@H](CC(=O)O)C)C
InChI 1S/C23H38O4/c1-13(10-21(26)27)17-6-7-18-16-5-4-14-11-15(24)8-9-22(14,2)19(16)12-20(25)23(17,18)3/h13-20,24-25H,4-12H2,1-3H3,(H,26,27)/t13-,14-,15-,16+,17-,18+,19+,20+,22+,23-/m1/s1
InChIKey PLRQOCVIINWCFA-AHFDLSHQSA-N
Properties
Density 1.142g/cm3 (Cal.)
Boiling point 536.663°C at 760 mmHg (Cal.)
Flash point 292.434°C (Cal.)
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