2'-guanidyl-2'-deaminogentamicin C1
TL;DR: 2'-guanidyl-2'-deaminogentamicin C1 (CAS 82089-23-4) is a chemical compound with molecular formula C22H45N7O7 and molecular weight 519.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2R,3R,6S)-2-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]guanidine
Also Known As: 2'-Guanidyl-2'-deaminogentamicin C1, S 86451, S-86451, 2-[(2R,3R,6S)-2-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]guanidine, D-Streptamine, O-2-((aminoiminomethyl)amino)-2,3,4,6,7-pentadeoxy-6-(methylamino)-alpha-D-ribo-heptopyranosyl-(1-4)-O-(3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6)-2-deoxy-
| Molecular Formula | C22H45N7O7 |
|---|---|
| Molecular Weight | 519.34 g/mol |
| LogP | -4.7 |
| Topological Polar Surface Area | 238.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 519.3381 |
| Heavy Atoms | 36 |
| Complexity | 748.0 |
Chemical Identifiers
| CAS Number | 82089-23-4 |
|---|---|
| SMILES | CC([C@@H]1CC[C@H]([C@H](O1)O[C@@H]2[C@H](C[C@H]([C@@H]([C@H]2O)OC3[C@@H]([C@H]([C@@](CO3)(C)O)NC)O)N)N)N=C(N)N)NC |
| InChIKey | GEKHQVFXSOIXGF-QXRPEJGYSA-N |
Product Overview
2'-guanidyl-2'-deaminogentamicin C1 (CAS 82089-23-4), with molecular formula C22H45N7O7 and molecular weight 519.34 g/mol. IUPAC: 2-[(2R,3R,6S)-2-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]guanidine.
Chemical Property Profile of 2'-guanidyl-2'-deaminogentamicin C1
Property Insights of 2'-guanidyl-2'-deaminogentamicin C1
The XLogP value of -4.7 indicates that 2'-guanidyl-2'-deaminogentamicin C1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 238.0 Ų indicates high polarity, suggesting 2'-guanidyl-2'-deaminogentamicin C1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-guanidyl-2'-deaminogentamicin C1 has 9 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 2'-guanidyl-2'-deaminogentamicin C1?
The CAS number of 2'-guanidyl-2'-deaminogentamicin C1 is 82089-23-4.
What is the molecular formula of 2'-guanidyl-2'-deaminogentamicin C1?
The molecular formula of 2'-guanidyl-2'-deaminogentamicin C1 is C22H45N7O7.
What is the molecular weight of 2'-guanidyl-2'-deaminogentamicin C1?
The molecular weight of 2'-guanidyl-2'-deaminogentamicin C1 is 519.34 g/mol.
Where can I buy 2'-guanidyl-2'-deaminogentamicin C1?
You can request a quote for 2'-guanidyl-2'-deaminogentamicin C1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-guanidyl-2'-deaminogentamicin C1?
Yes, KEHONG BIO provides custom synthesis services for 2'-guanidyl-2'-deaminogentamicin C1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.