Antibiotic A-31438
TL;DR: Antibiotic A-31438 (CAS 34698-88-9) is a chemical compound with molecular formula C28H50O10 and molecular weight 546.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Also Known As: ANTIBIOTIC A-31438, Erythromycin Impurity 52, 3-O-alpha-L-mycarosylerythronolide B, NCI60_001758, A 31438
| Molecular Formula | C28H50O10 |
|---|---|
| Molecular Weight | 546.34 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 546.3404 |
| Heavy Atoms | 38 |
| Complexity | 821.0 |
Chemical Identifiers
| CAS Number | 34698-88-9 |
|---|---|
| SMILES | CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)O)C)O)(C)O)C)C)O)C |
| InChIKey | WWWXDCNRNMZGEN-UHFFFAOYSA-N |
Product Overview
Antibiotic A-31438 (CAS 34698-88-9), with molecular formula C28H50O10 and molecular weight 546.34 g/mol. IUPAC: 4-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione.
Chemical Property Profile of Antibiotic A-31438
Property Insights of Antibiotic A-31438
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antibiotic A-31438. The TPSA of 163.0 Ų indicates high polarity, suggesting Antibiotic A-31438 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Antibiotic A-31438 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Antibiotic A-31438?
The CAS number of Antibiotic A-31438 is 34698-88-9.
What is the molecular formula of Antibiotic A-31438?
The molecular formula of Antibiotic A-31438 is C28H50O10.
What is the molecular weight of Antibiotic A-31438?
The molecular weight of Antibiotic A-31438 is 546.34 g/mol.
Where can I buy Antibiotic A-31438?
You can request a quote for Antibiotic A-31438 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibiotic A-31438?
Yes, KEHONG BIO provides custom synthesis services for Antibiotic A-31438 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.