3a-hydroxycholanic acid

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3α-hydroxycholanic acid; (4R)-4-[(3R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[α]phenanthren-17-yl]pentanoic acid; lithocholic acid
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CAS RN:[434-13-9]
Formula:C24H40O3; 376.58 g/mol
InChiKey:SMEROWZSTRWXGI-YPLGJCPNSA-N
SMILES:C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CCC4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Molecular structure of 3a-hydroxycholanic acid
Melting point:185 °C

Isomers

(1R,3R,4R)-3-[4-(1,1-dimethylheptyl)-2-hydroxyphenyl]-4-(3-hydroxypropyl)cyclohexan-1-ol
Molecular structure of (1R,3R,4R)-3-[4-(1,1-dimethylheptyl)-2-hydroxyphenyl]-4-(3-hydroxypropyl)cyclohexan-1-ol
2-ethylpentyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
Molecular structure of 2-ethylpentyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
12α-hydroxycholanic acid
Molecular structure of 12a-hydroxycholanic acid
12β-hydroxycholanic acid
Molecular structure of 12b-hydroxycholanic acid
3α-hydroxycholanic acid
Molecular structure of 3a-hydroxycholanic acid
3β-hydroxycholanic acid
Molecular structure of 3b-hydroxycholanic acid
6α-hydroxycholanic acid
Molecular structure of 6a-hydroxycholanic acid
7α-hydroxycholanic acid
Molecular structure of 7a-hydroxycholanic acid
12-hydroxycholan-24-oic acid
Molecular structure of 12-hydroxycholan-24-oic acid
3-(2-hydroxy-4-(1,1-dimethylheptyl)phenyl)-4-(3-hydroxypropyl)cyclohexanol
Molecular structure of 3-(2-hydroxy-4-(1,1-dimethylheptyl)phenyl)-4-(3-hydroxypropyl)cyclohexanol
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