3,7,12,23-四羟基胆甾烷-26-酸
TL;DR: 3,7,12,23-四羟基胆甾烷-26-酸 (CAS 121500-92-3) is a chemical compound with molecular formula C27H46O6 and molecular weight 466.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7,12,23-四羟基胆甾烷-26-酸
(6R)-4-hydroxy-2-methyl-6-[(8R,9S,10S,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]heptanoic acid
Also Known As: 3,7,12,23-Tetrahydroxycholestanoic acid, 3,7,12,23-THCA, 3,7,12,23-tetrahydroxycholestan-26-oic acid, 3alpha,7alpha,12alpha,23-Tetrahydroxy-5beta-cholestanoic acid, (6R)-4-hydroxy-2-methyl-6-[(8R,9S,10S,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]heptanoic acid
| Molecular Formula | C27H46O6 |
|---|---|
| Molecular Weight | 466.33 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 466.32944 |
| Heavy Atoms | 33 |
| Complexity | 727.0 |
Chemical Identifiers
| CAS Number | 121500-92-3 |
|---|---|
| SMILES | C[C@H](CC(CC(C)C(=O)O)O)[C@H]1CC[C@@H]2[C@@]1(C(C[C@H]3[C@H]2C(CC4[C@@]3(CCC(C4)O)C)O)O)C |
| InChIKey | MWMOIWJQWNZGCC-FOWZETMTSA-N |
Product Overview
3,7,12,23-四羟基胆甾烷-26-酸 (CAS 121500-92-3), with molecular formula C27H46O6 and molecular weight 466.33 g/mol. IUPAC: (6R)-4-hydroxy-2-methyl-6-[(8R,9S,10S,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]heptanoic acid.
Chemical Property Profile of 3,7,12,23-四羟基胆甾烷-26-酸
Property Insights of 3,7,12,23-四羟基胆甾烷-26-酸
The XLogP value of 3.9 indicates that 3,7,12,23-四羟基胆甾烷-26-酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,7,12,23-四羟基胆甾烷-26-酸. Following Lipinski's Rule of Five, 3,7,12,23-四羟基胆甾烷-26-酸 has 5 hydrogen bond donor(s) and 6 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 3,7,12,23-四羟基胆甾烷-26-酸?
The CAS number of 3,7,12,23-四羟基胆甾烷-26-酸 is 121500-92-3.
What is the molecular formula of 3,7,12,23-四羟基胆甾烷-26-酸?
The molecular formula of 3,7,12,23-四羟基胆甾烷-26-酸 is C27H46O6.
What is the molecular weight of 3,7,12,23-四羟基胆甾烷-26-酸?
The molecular weight of 3,7,12,23-四羟基胆甾烷-26-酸 is 466.33 g/mol.
Where can I buy 3,7,12,23-四羟基胆甾烷-26-酸?
You can request a quote for 3,7,12,23-四羟基胆甾烷-26-酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7,12,23-四羟基胆甾烷-26-酸?
Yes, KEHONG BIO provides custom synthesis services for 3,7,12,23-四羟基胆甾烷-26-酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.