3β-Cholic acid

CAS
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Purity
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CAS
3338-16-7
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Purity
96%
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Catalog Number

ACM3338167

Product Name

3β-Cholic acid

Structure

CAS

3338-16-7

Category

Heterocyclic Organic Compound

Synonyms

(3β,5β,7α,12α)-3,7,12-Trihydroxy-cholan-24-oic Acid; 3-Epicholic Acid; 3β,7α,12α-Trihydroxy-5β-cholanoic Acid;

IUPAC Name

(4R)-4-[(3S,5S,7R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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

Molecular Weight

413.60

Molecular Formula

C₂₄H₄₀O₅

Canonical SMILES

CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C

InChI Key

BHQCQFFYRZLCQQ-YZMSNRQASA-N

Boiling Point

583.9ºC at 760 mmHg

Flash Point

321ºC

Density

1.184g/cm³

Exact Mass

408.28800

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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Spec Sheet

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