Angolensic acid, methyl ester
TL;DR: Angolensic acid, methyl ester (CAS 2629-14-3) is a chemical compound with molecular formula C27H34O7 and molecular weight 470.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[13-(furan-3-yl)-6,6,8,12-tetramethyl-17-methylidene-5,15-dioxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate
Also Known As: METHYL ANGOLENSATE, Angolensic acid methyl ester, ERK5-4N11, ANGOLENSIC ACID, METHYL ESTER, Methyl (1alpha,5beta,13alpha,14beta,17aalpha)-1,14:21,23-diepoxy-4,4-dimethyl-3,16-dioxo-D-homo-24-nor-17-oxa-6,7-secachola-7,20,22-triene-6-carboxylate
| Molecular Formula | C27H34O7 |
|---|---|
| Molecular Weight | 470.23 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 470.23044 |
| Heavy Atoms | 34 |
| Complexity | 939.0 |
Chemical Identifiers
| CAS Number | 2629-14-3 |
|---|---|
| SMILES | CC1(C(C2(C3CCC4(C(OC(=O)CC4(C3=C)OC2CC1=O)C5=COC=C5)C)C)CC(=O)OC)C |
| InChIKey | YNMYHRYTRCKSMI-UHFFFAOYSA-N |
Product Overview
Angolensic acid, methyl ester (CAS 2629-14-3), with molecular formula C27H34O7 and molecular weight 470.23 g/mol. IUPAC: methyl 2-[13-(furan-3-yl)-6,6,8,12-tetramethyl-17-methylidene-5,15-dioxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate.
Chemical Property Profile of Angolensic acid, methyl ester
Property Insights of Angolensic acid, methyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Angolensic acid, methyl ester. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Angolensic acid, methyl ester. Following Lipinski's Rule of Five, Angolensic acid, methyl ester has 0 hydrogen bond donor(s) and 7 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 Angolensic acid, methyl ester?
The CAS number of Angolensic acid, methyl ester is 2629-14-3.
What is the molecular formula of Angolensic acid, methyl ester?
The molecular formula of Angolensic acid, methyl ester is C27H34O7.
What is the molecular weight of Angolensic acid, methyl ester?
The molecular weight of Angolensic acid, methyl ester is 470.23 g/mol.
Where can I buy Angolensic acid, methyl ester?
You can request a quote for Angolensic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Angolensic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Angolensic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.