Awamycin
TL;DR: Awamycin (CAS 87913-35-7) is a chemical compound with molecular formula C38H49NO12S and molecular weight 743.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-methylsulfanyl-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
Also Known As: Awamycin, Methyl 2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-methylsulfanyl-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
| Molecular Formula | C38H49NO12S |
|---|---|
| Molecular Weight | 743.30 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 242.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 743.29755 |
| Heavy Atoms | 52 |
| Complexity | 1520.0 |
Chemical Identifiers
| CAS Number | 87913-35-7 |
|---|---|
| SMILES | CC1C=CC=C(C(=O)NC2=C(C(=O)C3=C(C2=O)C(=C(C(=C3C(=O)C(=CC(C(C(C(C(C(C(C1O)C)O)C(=O)OC)O)C)O)C)C)OC)C)O)SC)C |
| InChIKey | WZCNXFSCUFEMGW-UHFFFAOYSA-N |
Product Overview
Awamycin (CAS 87913-35-7), with molecular formula C38H49NO12S and molecular weight 743.30 g/mol. IUPAC: methyl 2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-methylsulfanyl-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate.
Chemical Property Profile of Awamycin
Property Insights of Awamycin
The XLogP value of 4.4 indicates that Awamycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 242.0 Ų indicates high polarity, suggesting Awamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Awamycin has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Awamycin?
The CAS number of Awamycin is 87913-35-7.
What is the molecular formula of Awamycin?
The molecular formula of Awamycin is C38H49NO12S.
What is the molecular weight of Awamycin?
The molecular weight of Awamycin is 743.30 g/mol.
Where can I buy Awamycin?
You can request a quote for Awamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Awamycin?
Yes, KEHONG BIO provides custom synthesis services for Awamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.