4',5''-Dideoxy-5''-guanidinbutirosin A
TL;DR: 4',5''-Dideoxy-5''-guanidinbutirosin A (CAS 133218-68-5) is a chemical compound with molecular formula C22H44N8O11 and molecular weight 596.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-[5-amino-4-[3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-[5-[(diaminomethylideneamino)methyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide
Also Known As: 4',5''-Dideoxy-5''-guanidinbutirosin A, D-Streptamine, O-5-((aminoiminomethyl)amino)-5-deoxy-beta-xylofuranosyl-(1-5)-O-(2,6-diamino-2,6-dideoxy-4',5''-dideoxy-5''-guanidinobutirosin A alpha-D-glucopyranosyl-(1-4))-N(sup 1)-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-, D-Strptamine, O-5-((aminoiminomethyl)amino)-5-deoxy-beta-D-xylofuranosyl-(1-5)-O-(2,6-diamino-2,6-didexy-alpha-D-glucopyranosyl-(1-4))-N1-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-, 4-Amino-N-(5-amino-3-{[5-(carbamimidoylamino)-5-deoxypentofuranosyl]oxy}-4-[(2,6-diamino-2,6-dideoxyhexopyranosyl)oxy]-2-hydroxycyclohexyl)-2-hydroxybutanimidic acid, 4-amino-N-[5-amino-4-[3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-[5-[(diaminomethylideneamino)methyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide
| Molecular Formula | C22H44N8O11 |
|---|---|
| Molecular Weight | 596.31 g/mol |
| LogP | -8.504 |
| Topological Polar Surface Area | 355.88 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 596.3129 |
| Heavy Atoms | 41 |
| Complexity | 886.4748 |
Chemical Identifiers
| CAS Number | 133218-68-5 |
|---|---|
| SMILES | C1C(C(C(C(C1NC(=O)C(CCN)O)O)OC2C(C(C(O2)CN=C(N)N)O)O)OC3C(C(C(C(O3)CN)O)O)N)N |
Product Overview
4',5''-Dideoxy-5''-guanidinbutirosin A (CAS 133218-68-5), with molecular formula C22H44N8O11 and molecular weight 596.31 g/mol. IUPAC: 4-amino-N-[5-amino-4-[3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-[5-[(diaminomethylideneamino)methyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide.
Chemical Property Profile of 4',5''-Dideoxy-5''-guanidinbutirosin A
Property Insights of 4',5''-Dideoxy-5''-guanidinbutirosin A
The XLogP value of -8.504 indicates that 4',5''-Dideoxy-5''-guanidinbutirosin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 355.88 Ų indicates high polarity, suggesting 4',5''-Dideoxy-5''-guanidinbutirosin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4',5''-Dideoxy-5''-guanidinbutirosin A has 13 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 4',5''-Dideoxy-5''-guanidinbutirosin A?
The CAS number of 4',5''-Dideoxy-5''-guanidinbutirosin A is 133218-68-5.
What is the molecular formula of 4',5''-Dideoxy-5''-guanidinbutirosin A?
The molecular formula of 4',5''-Dideoxy-5''-guanidinbutirosin A is C22H44N8O11.
What is the molecular weight of 4',5''-Dideoxy-5''-guanidinbutirosin A?
The molecular weight of 4',5''-Dideoxy-5''-guanidinbutirosin A is 596.31 g/mol.
Where can I buy 4',5''-Dideoxy-5''-guanidinbutirosin A?
You can request a quote for 4',5''-Dideoxy-5''-guanidinbutirosin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4',5''-Dideoxy-5''-guanidinbutirosin A?
Yes, KEHONG BIO provides custom synthesis services for 4',5''-Dideoxy-5''-guanidinbutirosin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.