Bengamide E
TL;DR: Bengamide E (CAS 118477-03-5) is a chemical compound with molecular formula C17H30N2O6 and molecular weight 358.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,2R,3R,4S,5R)-3,4,5-trihydroxy-2-methoxy-8-methyl-N-[(3S)-2-oxoazepan-3-yl]non-6-enamide
Also Known As: Bengamide E, (+)-Bengamide E, (E,2R,3R,4S,5R)-3,4,5-trihydroxy-2-methoxy-8-methyl-N-[(3S)-2-oxoazepan-3-yl]non-6-enamide, (2R,3R,4S,5R,6E)-3,4,5-TRIHYDROXY-2-METHOXY-8-METHYL-N-[(3S)-2-OXOAZEPAN-3-YL]NON-6-ENAMIDE, (2R,3R,4S,5R,6E)-3,4,5-Trihydroxy-2-methoxy-8-methyl-N-[[(3S)-hexahydro-2-oxo-1H-azepin]-3beta-yl]-6-nonenamide
| Molecular Formula | C17H30N2O6 |
|---|---|
| Molecular Weight | 358.21 g/mol |
| LogP | -0.9188 |
| Topological Polar Surface Area | 128.12 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 358.2104 |
| Heavy Atoms | 25 |
| Complexity | 468.0544 |
Chemical Identifiers
| CAS Number | 118477-03-5 |
|---|---|
| SMILES | CC(C)/C=C/[C@H]([C@@H]([C@H]([C@H](C(=O)N[C@H]1CCCCNC1=O)OC)O)O)O |
Product Overview
Bengamide E (CAS 118477-03-5), with molecular formula C17H30N2O6 and molecular weight 358.21 g/mol. IUPAC: (E,2R,3R,4S,5R)-3,4,5-trihydroxy-2-methoxy-8-methyl-N-[(3S)-2-oxoazepan-3-yl]non-6-enamide.
Chemical Property Profile of Bengamide E
Property Insights of Bengamide E
The XLogP value of -0.9188 indicates that Bengamide E is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 128.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Bengamide E. Following Lipinski's Rule of Five, Bengamide E has 5 hydrogen bond donor(s) and 6 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 Bengamide E?
The CAS number of Bengamide E is 118477-03-5.
What is the molecular formula of Bengamide E?
The molecular formula of Bengamide E is C17H30N2O6.
What is the molecular weight of Bengamide E?
The molecular weight of Bengamide E is 358.21 g/mol.
Where can I buy Bengamide E?
You can request a quote for Bengamide E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bengamide E?
Yes, KEHONG BIO provides custom synthesis services for Bengamide E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.