富马海松酸
TL;DR: 富马海松酸 (CAS 125-66-6) is a chemical compound with molecular formula C24H34O6 and molecular weight 418.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
富马海松酸
5,9-dimethyl-16-propan-2-yltetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5,13,14-tricarboxylic acid
Also Known As: Fumaropimaric acid, NCI60_001103, 4,4a,4b,5,6,7,8,8a,9,10-decahydro-4b,8-dimethyl-2-(1-methylethyl)-3H-3,10a-ethanophenanthrene-8,11,12-tricarboxylic acid, 15-carboxy-13-isopropylatis-13-ene-17,18-dioic acid, 5,9-Dimethyl-16-propan-2-yltetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5,13,14-tricarboxylic acid
| Molecular Formula | C24H34O6 |
|---|---|
| Molecular Weight | 418.24 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.23553 |
| Heavy Atoms | 30 |
| Complexity | 830.0 |
Chemical Identifiers
| CAS Number | 125-66-6 |
|---|---|
| SMILES | CC(C)C1=CC23CCC4C(C2CC1C(C3C(=O)O)C(=O)O)(CCCC4(C)C(=O)O)C |
| InChIKey | PXYRCOIAFZBLBN-UHFFFAOYSA-N |
Product Overview
富马海松酸 (CAS 125-66-6), with molecular formula C24H34O6 and molecular weight 418.24 g/mol. IUPAC: 5,9-dimethyl-16-propan-2-yltetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5,13,14-tricarboxylic acid.
Chemical Property Profile of 富马海松酸
Property Insights of 富马海松酸
The XLogP value of 4.2 indicates that 富马海松酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 富马海松酸. Following Lipinski's Rule of Five, 富马海松酸 has 3 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 富马海松酸?
The CAS number of 富马海松酸 is 125-66-6.
What is the molecular formula of 富马海松酸?
The molecular formula of 富马海松酸 is C24H34O6.
What is the molecular weight of 富马海松酸?
The molecular weight of 富马海松酸 is 418.24 g/mol.
Where can I buy 富马海松酸?
You can request a quote for 富马海松酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 富马海松酸?
Yes, KEHONG BIO provides custom synthesis services for 富马海松酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.