5a-Cholestane-3a,7a,12a,25-tetrol

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[edit] Description

Show 3-D Structure

5a-Cholestane-3a,7a,12a,25-tetrol is a bile alcohols which is excreted mainly as glucurono-conjugates in bile and urine, and as unconjugated form in feces of patients with cerebrotendinous xanthomatosis (PMID 3700361)

[edit] General Properties

*Molecular Weight

436.67

*Molecular Formula

C27H48O4

*IUPAC NAME

(3a,5a,7a,12a)-Cholestane-3,7,12,25-tetrol

*Canonical Smiles

CC(CCCC(C)(C)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C

*Isomeric Smiles

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C


[edit] PhysioChemical Properties

*Melting Point


*LogP


*Water Solubility


[edit] External Links

  • [1]Human Metabolome DataBase