羊角衣酸
TL;DR: 羊角衣酸 (CAS 644-66-6) is a chemical compound with molecular formula C19H18O8 and molecular weight 374.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羊角衣酸
4-(3-formyl-2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-2-hydroxy-3,6-dimethylbenzoic acid
Also Known As: Baeomycesic acid, Baeomycesicacid, Baeomycessaure, Beomycesic acid, ERK5-5A20
| Molecular Formula | C19H18O8 |
|---|---|
| Molecular Weight | 374.10 g/mol |
| LogP | 2.76156 |
| Topological Polar Surface Area | 130.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.10016 |
| Heavy Atoms | 27 |
| Complexity | 959.1576 |
Chemical Identifiers
| CAS Number | 644-66-6 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C(=O)O)O)C)OC(=O)C2=C(C(=C(C=C2C)OC)C=O)O |
Product Overview
羊角衣酸 (CAS 644-66-6), with molecular formula C19H18O8 and molecular weight 374.10 g/mol. IUPAC: 4-(3-formyl-2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-2-hydroxy-3,6-dimethylbenzoic acid.
Chemical Property Profile of 羊角衣酸
Property Insights of 羊角衣酸
The XLogP value of 2.76156 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 羊角衣酸. The TPSA of 130.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 羊角衣酸. Following Lipinski's Rule of Five, 羊角衣酸 has 3 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 羊角衣酸?
The CAS number of 羊角衣酸 is 644-66-6.
What is the molecular formula of 羊角衣酸?
The molecular formula of 羊角衣酸 is C19H18O8.
What is the molecular weight of 羊角衣酸?
The molecular weight of 羊角衣酸 is 374.10 g/mol.
Where can I buy 羊角衣酸?
You can request a quote for 羊角衣酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羊角衣酸?
Yes, KEHONG BIO provides custom synthesis services for 羊角衣酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.