5-epi-Sisomicin
TL;DR: 5-epi-Sisomicin (CAS 55870-64-9) is a chemical compound with molecular formula C19H37N5O7 and molecular weight 447.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4R,5R)-2-[(1S,2R,3R,4S,6R)-4,6-diamino-3-[[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol
Also Known As: Pentisomicin, 5-Episisomicin, Pentisomicina, Pentisomicine, 5-epi-Sisomicin
| Molecular Formula | C19H37N5O7 |
|---|---|
| Molecular Weight | 447.27 g/mol |
| LogP | -5.1 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.2693 |
| Heavy Atoms | 31 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 55870-64-9 |
|---|---|
| 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](CC=C(O3)CN)N)N)N)O |
| InChIKey | URWAJWIAIPFPJE-VHLNBGGKSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-epi-Sisomicin (CAS 55870-64-9), with molecular formula C19H37N5O7 and molecular weight 447.27 g/mol. IUPAC: (2R,3R,4R,5R)-2-[(1S,2R,3R,4S,6R)-4,6-diamino-3-[[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol.
Chemical Property Profile of 5-epi-Sisomicin
Property Insights of 5-epi-Sisomicin
The XLogP value of -5.1 indicates that 5-epi-Sisomicin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting 5-epi-Sisomicin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-epi-Sisomicin has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-epi-Sisomicin?
The CAS number of 5-epi-Sisomicin is 55870-64-9.
What is the molecular formula of 5-epi-Sisomicin?
The molecular formula of 5-epi-Sisomicin is C19H37N5O7.
What is the molecular weight of 5-epi-Sisomicin?
The molecular weight of 5-epi-Sisomicin is 447.27 g/mol.
Where can I buy 5-epi-Sisomicin?
You can request a quote for 5-epi-Sisomicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-epi-Sisomicin?
Yes, KEHONG BIO provides custom synthesis services for 5-epi-Sisomicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.