(22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid
TL;DR: (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid (CAS 110107-03-4) is a chemical compound with molecular formula C24H38O4 and molecular weight 390.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pent-2-enoic acid
Also Known As: Ursodeoxycholic acid impurity 61, Ursodeoxycholic Acid Impurity 41, Urosodeoxycholic Acid EP Impurity M, (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid, 3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic acid
| Molecular Formula | C24H38O4 |
|---|---|
| Molecular Weight | 390.28 g/mol |
| LogP | 4.2539 |
| Topological Polar Surface Area | 77.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.277 |
| Heavy Atoms | 28 |
| Complexity | 644.5164 |
Chemical Identifiers
| CAS Number | 110107-03-4 |
|---|---|
| SMILES | C[C@H](/C=C/C(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
Product Overview
(22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid (CAS 110107-03-4), with molecular formula C24H38O4 and molecular weight 390.28 g/mol. IUPAC: (E,4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pent-2-enoic acid.
Chemical Property Profile of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid
Property Insights of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid
The XLogP value of 4.2539 indicates that (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid. Following Lipinski's Rule of Five, (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid has 3 hydrogen bond donor(s) and 3 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 (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid?
The CAS number of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid is 110107-03-4.
What is the molecular formula of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid?
The molecular formula of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid is C24H38O4.
What is the molecular weight of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid?
The molecular weight of (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid is 390.28 g/mol.
Where can I buy (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid?
You can request a quote for (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid?
Yes, KEHONG BIO provides custom synthesis services for (22E)-3alpha,7alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.