6'''-O-Mannopyranosyl mannosidostreptomycin
TL;DR: 6'''-O-Mannopyranosyl mannosidostreptomycin (CAS 100759-54-4) is a chemical compound with molecular formula C33H59N7O22 and molecular weight 905.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(diaminomethylideneamino)-4-[4-formyl-4-hydroxy-3-[4-hydroxy-6-(hydroxymethyl)-3-(methylamino)-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine
Also Known As: 6'''-Mpms, 6'''-O-Mannopyranosyl mannosidostreptomycin, 2-[3-(diaminomethylideneamino)-4-[4-formyl-4-hydroxy-3-[4-hydroxy-6-(hydroxymethyl)-3-(methylamino)-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine, 2,2'-(4-{[hexopyranosyl-(1->6)hexopyranosyl-(1->4)-2-deoxy-2-(methylamino)hexopyranosyl-(1->2)-5-deoxy-3-C-formylpentofuranosyl]oxy}-2,5,6-trihydroxycyclohexane-1,3-diyl)diguanidine, 2-(3-(diaminomethylideneamino)-4-(4-formyl-4-hydroxy-3-(4-hydroxy-6-(hydroxymethyl)-3-(methylamino)-5-(3,4,5-trihydroxy-6-((3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxymethyl)oxan-2-yl)oxyoxan-2-yl)oxy-5-methyloxolan-2-yl)oxy-2,5,6-trihydroxycyclohexyl)guanidine
| Molecular Formula | C33H59N7O22 |
|---|---|
| Molecular Weight | 905.37 g/mol |
| LogP | -12.3 |
| Topological Polar Surface Area | 495.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 15 |
| Exact Mass | 905.37134 |
| Heavy Atoms | 62 |
| Complexity | 1540.0 |
Chemical Identifiers
| CAS Number | 100759-54-4 |
|---|---|
| SMILES | CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)NC)(C=O)O |
| InChIKey | XIKSUQAETDPAAY-UHFFFAOYSA-N |
Product Overview
6'''-O-Mannopyranosyl mannosidostreptomycin (CAS 100759-54-4), with molecular formula C33H59N7O22 and molecular weight 905.37 g/mol. IUPAC: 2-[3-(diaminomethylideneamino)-4-[4-formyl-4-hydroxy-3-[4-hydroxy-6-(hydroxymethyl)-3-(methylamino)-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine.
Chemical Property Profile of 6'''-O-Mannopyranosyl mannosidostreptomycin
Property Insights of 6'''-O-Mannopyranosyl mannosidostreptomycin
The XLogP value of -12.3 indicates that 6'''-O-Mannopyranosyl mannosidostreptomycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 495.0 Ų indicates high polarity, suggesting 6'''-O-Mannopyranosyl mannosidostreptomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6'''-O-Mannopyranosyl mannosidostreptomycin has 18 hydrogen bond donor(s) and 25 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6'''-O-Mannopyranosyl mannosidostreptomycin?
The CAS number of 6'''-O-Mannopyranosyl mannosidostreptomycin is 100759-54-4.
What is the molecular formula of 6'''-O-Mannopyranosyl mannosidostreptomycin?
The molecular formula of 6'''-O-Mannopyranosyl mannosidostreptomycin is C33H59N7O22.
What is the molecular weight of 6'''-O-Mannopyranosyl mannosidostreptomycin?
The molecular weight of 6'''-O-Mannopyranosyl mannosidostreptomycin is 905.37 g/mol.
Where can I buy 6'''-O-Mannopyranosyl mannosidostreptomycin?
You can request a quote for 6'''-O-Mannopyranosyl mannosidostreptomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6'''-O-Mannopyranosyl mannosidostreptomycin?
Yes, KEHONG BIO provides custom synthesis services for 6'''-O-Mannopyranosyl mannosidostreptomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.