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CAS RN 434-13-9

CH3(R)HOO(R)(S)(R)(R)(R)OH(S)H3C(S)(R)H3C

CAS RN 434-13-9

IUPAC Name: (4R)-4-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-7-hydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
Synonyms: lithocholic acid 3α-hydroxy-5β-cholanoic acid
Molecular Weight (g/mol): 376.58
Molecular Formula: C24H40O3
InChi Key: SMEROWZSTRWXGI-HVATVPOCSA-N
SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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Lithocholic acid, 95%

CAS: 434-13-9 Molecular Formula: C24H40O3 Molecular Weight (g/mol): 376.581 MDL Number: MFCD00003682 InChI Key: SMEROWZSTRWXGI-HVATVPOCSA-N Synonym: lithocholic acid,lithocolic acid,lithocholate,3alpha-hydroxy-5beta-cholanic acid,3alpha-hydroxy-5beta-cholan-24-oic acid,3-hydroxycholan-24-oic acid,3alpha-hydroxycholanic acid,3-alpha-hydroxycholanic acid,5beta-cholanic acid-3alpha-ol,3alpha-hydroxy-5beta-cholanoic acid PubChem CID: 9903 ChEBI: CHEBI:16325 IUPAC Name: (4R)-4-[(3R,5R,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[a]phenanthren-17-yl]pentanoic acid SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C

PubChem CID 9903
CAS 434-13-9
Molecular Weight (g/mol) 376.581
ChEBI CHEBI:16325
MDL Number MFCD00003682
SMILES CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C
Synonym lithocholic acid,lithocolic acid,lithocholate,3alpha-hydroxy-5beta-cholanic acid,3alpha-hydroxy-5beta-cholan-24-oic acid,3-hydroxycholan-24-oic acid,3alpha-hydroxycholanic acid,3-alpha-hydroxycholanic acid,5beta-cholanic acid-3alpha-ol,3alpha-hydroxy-5beta-cholanoic acid
IUPAC Name (4R)-4-[(3R,5R,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[a]phenanthren-17-yl]pentanoic acid
InChI Key SMEROWZSTRWXGI-HVATVPOCSA-N
Molecular Formula C24H40O3
2

3alpha-Hydroxy-5beta-cholan-24-oic Acid (Lithocholic Acid), Mikromol™

Discover Mikromol - your trusted source for high-quality pharmaceutical reference standards. Supporting accurate, compliant analysis with ISO 17034-accredited materials designed for confidence in every result.

3

Lithocholic acid, MedChemExpress

MedChemExpress Lithocholic acid is a toxic secondary bile acid, causes intrahepatic cholestasis, has tumor-promoting activity.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 376.57
Color White
Physical Form Powder
Chemical Name or Material Lithocholic acid
Grade Research
SMILES C[C@@]12[C@](CC[C@]2([H])[C@H](C)CCC(O)=O)([H])[C@@]3([H])[C@]([C@@]4([C@](C[C@H](O)CC4)([H])CC3)C)([H])CC1
For Use With (Application) Metabolism-sugar/lipid metabolism
Percent Purity 98.0%
CAS 434-13-9
Solubility Information DMSO : 250 mg/mL (663.89 mM; Need ultrasonic) ∣Ethanol : 10 mg/mL (26.56 mM; ultrasonic and warming and heat to 60°C)
Synonym 3α-Hydroxy-5β-cholanic acid
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C24H40O3
Formula Weight 376.57