Carpetimycin B
TL;DR: Carpetimycin B (CAS 76094-36-5) is a chemical compound with molecular formula C14H18N2O9S2 and molecular weight 422.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6R)-3-[(E)-2-acetamidoethenyl]sulfinyl-7-oxo-6-(2-sulfooxypropan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Also Known As: Carpetimycin B, Antibiotic C-19393S2, C-19393S2, C-19393 S(2), (5R)-3-[[(E)-2-(Acetylamino)ethenyl]sulfinyl]-6alpha-[1-methyl-1-(sulfooxy)ethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
| Molecular Formula | C14H18N2O9S2 |
|---|---|
| Molecular Weight | 422.05 g/mol |
| LogP | -0.5327 |
| Topological Polar Surface Area | 167.38 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.04538 |
| Heavy Atoms | 27 |
| Complexity | 888.26404 |
Chemical Identifiers
| CAS Number | 76094-36-5 |
|---|---|
| SMILES | CC(=O)N/C=C/S(=O)C1=C(N2[C@H](C1)[C@@H](C2=O)C(C)(C)OS(=O)(=O)O)C(=O)O |
Product Overview
Carpetimycin B (CAS 76094-36-5), with molecular formula C14H18N2O9S2 and molecular weight 422.05 g/mol. IUPAC: (5R,6R)-3-[(E)-2-acetamidoethenyl]sulfinyl-7-oxo-6-(2-sulfooxypropan-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid.
Chemical Property Profile of Carpetimycin B
Property Insights of Carpetimycin B
The XLogP value of -0.5327 indicates that Carpetimycin B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.38 Ų indicates high polarity, suggesting Carpetimycin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Carpetimycin B 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 Carpetimycin B?
The CAS number of Carpetimycin B is 76094-36-5.
What is the molecular formula of Carpetimycin B?
The molecular formula of Carpetimycin B is C14H18N2O9S2.
What is the molecular weight of Carpetimycin B?
The molecular weight of Carpetimycin B is 422.05 g/mol.
Where can I buy Carpetimycin B?
You can request a quote for Carpetimycin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carpetimycin B?
Yes, KEHONG BIO provides custom synthesis services for Carpetimycin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.