3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid
TL;DR: 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid (CAS 100772-18-7) is a chemical compound with molecular formula C23H32O3 and molecular weight 356.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R)-4-[(8S,9S,13R,14S,17R)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
Also Known As: 3-HNCOA, 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid, 3-Hydroxy-19-norchola-1,3,5(10)-trien-24-oic acid, 3-Hydroxy-19-norchola-1(10),2,4-trien-24-oic acid, 19-Norchola-1,3,5(10)-trien-24-oic acid, 3-hydroxy-
| Molecular Formula | C23H32O3 |
|---|---|
| Molecular Weight | 356.24 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.23514 |
| Heavy Atoms | 26 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 100772-18-7 |
|---|---|
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C |
| InChIKey | XMOYAJSUUCZZLU-XLAFRRDFSA-N |
Product Overview
3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid (CAS 100772-18-7), with molecular formula C23H32O3 and molecular weight 356.24 g/mol. IUPAC: (4R)-4-[(8S,9S,13R,14S,17R)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid.
Chemical Property Profile of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid
Property Insights of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid
The XLogP value of 6.0 indicates that 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid?
The CAS number of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid is 100772-18-7.
What is the molecular formula of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid?
The molecular formula of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid is C23H32O3.
What is the molecular weight of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid?
The molecular weight of 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid is 356.24 g/mol.
Where can I buy 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid?
You can request a quote for 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-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 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-19-nor-1,3,5(10)-cholatrien-24-oic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.