Name: 3β,5α,6β-Trihydroxycholanic Acid
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HIT ID:HIT218832834
Cas No:
Common Name:3β,5α,6β-Trihydroxycholanic Acid
Common Name:3β,5α,6β-Trihydroxycholanic Acid
IUPAC:4-{5,5a,7-trihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}pentanoic acid
IUPAC:4-{5,5a,7-trihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}pentanoic acid
InChIKey:NMKAZCXSXYNCFW-UHFFFAOYSA-N

Molecular Formula:C24H40O5
Molecular Weight:408.579
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:CC(CCC(O)=O)C1CCC2C3CC(O)C4(O)CC(O)CCC4(C)C3CCC12C
SMILES:CC(CCC(O)=O)C1CCC2C3CC(O)C4(O)CC(O)CCC4(C)C3CCC12C

3β,5α,6β-Trihydroxycholanic acid, a metabolite derived from 5α,6β-dihydroxycholestanol, exhibits elevated levels in dried blood spots of patients diagnosed with Niemann-Pick disease type C, a neurodegenerative disorder characterized by the accumulation of cholesterol and sphingolipids in lysosomes.

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