Catalog No.:AA009JJ2

130593-75-8 | Cholic Acid Impurity (5-beta-Cholane-3-alpha-7-beta-24-Triol)

Name: Name:Cholic Acid Impurity (5-beta-Cholane-3-alpha-7-beta-24-Triol)
Brand: AABLOCKS
SKU: AA009JJ2
Availability: InStock
Rating: 90 (10 reviews)

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25mg

2 weeks

$531.00 $372.00

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125mg

2 weeks

$1,347.00 $943.00

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA009JJ2

Chemical Name:

Cholic Acid Impurity (5-beta-Cholane-3-alpha-7-beta-24-Triol)

CAS Number:

130593-75-8

Molecular Formula:

C24H42O3

Molecular Weight:

378.5885

SMILES:

OCCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2[C@@H](O)C[C@H]2[C@]1(C)CC[C@H](C2)O)C

Properties

Computed Properties

Complexity:

536

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

5.1

Literature

Title: Novel potent and selective bile acid derivatives as TGR5 agonists: biological screening, structure-activity relationships, and molecular modeling studies.

Journal: Journal of medicinal chemistry 20080327

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