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Chemical structure of N-butyl Lithocholic Acid

GC92013

N-butyl Lithocholic Acid

Also known as butyl (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]pentanoate

N-butyl Lithocholic acid is a derivative of the secondary bile acid lithocholic acid

ChemicalCAS135013-42-2MW432.7FormulaC28H48O3
CAS number
135013-42-2
Molecular weight
432.7
Formula
C28H48O3
Solubility
DMSO： Slightly soluble： 0·1–1 mg/ml,Ethanol： Sparingly soluble： 1–10 mg/ml
InChIKey
DVARNCCRARJWLO-WQKHHYSQSA-N
Catalogue number
GC92013
Brand
GLPBIO
Computed properties PubChem CID 15056430 · XLogP 7.8 · TPSA 46.5 Ų · H-bond donors 1
XLogP
7.8
TPSA
46.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
31

SMILES CCCCOC(=O)CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C

Computed descriptors from PubChem (CID 15056430), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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