Norursocholic acid
TL;DR: Norursocholic acid (CAS 139265-35-3) is a chemical compound with molecular formula C23H38O5 and molecular weight 394.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-[(5R,10S,13R,17R)-2,3,3-trihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]butanoic acid
Also Known As: Norursocholic acid, (3R)-3-[(5R,10S,13R,17R)-2,3,3-trihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]butanoic acid, 24-Norcholan-23-oic acid, 3,7,12-trihydroxy-, (3alpha,5beta,7beta,12alpha)-, 3-(3alpha,7beta,12alpha-Trihydroxy-5beta,17beta-androstan-17-yl)butanoic acid, 3-(3 alpha, 7 beta, 12 alpha-trihydroxy-5 beta, 17 beta-androstan-17-yl)butanoic acid
| Molecular Formula | C23H38O5 |
|---|---|
| Molecular Weight | 394.27 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.2719 |
| Heavy Atoms | 28 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 139265-35-3 |
|---|---|
| SMILES | C[C@H](CC(=O)O)[C@H]1CCC2[C@@]1(CCC3C2CC[C@H]4[C@@]3(CC(C(C4)(O)O)O)C)C |
| InChIKey | UJNJKJCBHLCOMS-QTOAEDRXSA-N |
Product Overview
Norursocholic acid (CAS 139265-35-3), with molecular formula C23H38O5 and molecular weight 394.27 g/mol. IUPAC: (3R)-3-[(5R,10S,13R,17R)-2,3,3-trihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]butanoic acid.
Chemical Property Profile of Norursocholic acid
Property Insights of Norursocholic acid
The XLogP value of 4.2 indicates that Norursocholic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Norursocholic acid. Following Lipinski's Rule of Five, Norursocholic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Norursocholic acid?
The CAS number of Norursocholic acid is 139265-35-3.
What is the molecular formula of Norursocholic acid?
The molecular formula of Norursocholic acid is C23H38O5.
What is the molecular weight of Norursocholic acid?
The molecular weight of Norursocholic acid is 394.27 g/mol.
Where can I buy Norursocholic acid?
You can request a quote for Norursocholic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Norursocholic acid?
Yes, KEHONG BIO provides custom synthesis services for Norursocholic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.