3alpha,6alpha-Dihydroxycholanic acid structure

3alpha,6alpha-Dihydroxycholanic acid

4-(3,6-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)pentanoic acid

Also Known As: HYODEOXYCHOLIC ACID|Murocholic acid|Hyodeoxycholic|Hyodesoxycholic acid|Murideoxycholic acid|4- pentanoicacid|Iodeoxycholic acid|Hyodesoxycholsaeure|b-Hyodeoxycholic acid|7-Deoxyhyocholic acid|.alpha.-Hyodeoxycholic acid|HYODESOXY CHOLIC ACID|NCIOpen2_007753|Oprea1_634816|6-alpha-Hydroxylithocholic acid|5?-Cholanic Acid-3?,6?-diol|3,6-Dihydroxycholan-24-oic acid|3alpha,6alpha-Dihydroxycholanic acid|EINECS 201-483-2|3?,6?-Dihydroxy-5?-cholanic Acid|3.alpha.,6.alpha.-Dihydroxycholanic acid|3?,6?-Dihydroxy-5?-cholan-24-oic Acid|4-(3,6-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)pentanoic acid|5-beta-Cholanic acid-3-alpha,6-alpha-diol|(3a,6a)-3,6-Dihydroxycholan-24-oic acid|3alpha,6alpha-Dihydroxy-5beta-cholanoic acid

CAS: 570-84-3
Molecular Formula C24H40O4
Molecular Weight 392.29266 g/mol
LogP 4.9
Topological Polar Surface Area 77.8 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 392.29266
Monoisotopic Mass 392.29266
Heavy Atoms 28
Complexity 605.0

Chemical Identifiers

CAS Number 570-84-3
SMILES CC(CCC(=O)O)C1CCC2C1(CCC3C2CC(C4C3(CCC(C4)O)C)O)C
InChIKey DGABKXLVXPYZII-UHFFFAOYSA-N

Product Overview

3alpha,6alpha-Dihydroxycholanic acid (CAS 570-84-3), with molecular formula C24H40O4 and molecular weight 392.29266 g/mol. IUPAC: 4-(3,6-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)pentanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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