Isepamicin
TL;DR: Isepamicin (CAS 58155-53-6) is a chemical compound with molecular formula C22H43N5O12 and molecular weight 569.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxypropanamide
Also Known As: Isepamicin, Isepamicine, Isepamicina, Isepamicinum, HAPA-B
| Molecular Formula | C22H43N5O12 |
|---|---|
| Molecular Weight | 569.29 g/mol |
| LogP | -7.5244 |
| Topological Polar Surface Area | 297.72 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 569.29083 |
| Heavy Atoms | 39 |
| Complexity | 811.394 |
Chemical Identifiers
| CAS Number | 58155-53-6 |
|---|---|
| SMILES | C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N)NC(=O)[C@H](CN)O)O |
Product Overview
Isepamicin (CAS 58155-53-6), with molecular formula C22H43N5O12 and molecular weight 569.29 g/mol. IUPAC: (2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxypropanamide.
Chemical Property Profile of Isepamicin
Property Insights of Isepamicin
The XLogP value of -7.5244 indicates that Isepamicin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 297.72 Ų indicates high polarity, suggesting Isepamicin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isepamicin has 12 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isepamicin?
The CAS number of Isepamicin is 58155-53-6.
What is the molecular formula of Isepamicin?
The molecular formula of Isepamicin is C22H43N5O12.
What is the molecular weight of Isepamicin?
The molecular weight of Isepamicin is 569.29 g/mol.
Where can I buy Isepamicin?
You can request a quote for Isepamicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isepamicin?
Yes, KEHONG BIO provides custom synthesis services for Isepamicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.