p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside
TL;DR: p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside (CAS 1039067-33-8) is a chemical compound with molecular formula C30H45NO23 and molecular weight 787.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-6-[[5-hydroxy-6-(4-nitrophenoxy)-3,4-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]methoxy]oxane-3,4,5-triol
Also Known As: 4-Nitrophenyl 3,4,6-tri-O-(a-D-mannopyranosyl)-b-D-mannopyranoside, p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside, 2-(hydroxymethyl)-6-[[5-hydroxy-6-(4-nitrophenoxy)-3,4-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]methoxy]oxane-3,4,5-triol
| Molecular Formula | C30H45NO23 |
|---|---|
| Molecular Weight | 787.24 g/mol |
| LogP | -7.7539 |
| Topological Polar Surface Area | 379.97 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 13 |
| Exact Mass | 787.2382 |
| Heavy Atoms | 54 |
| Complexity | 1340.8743 |
Chemical Identifiers
| CAS Number | 1039067-33-8 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O |
Product Overview
p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside (CAS 1039067-33-8), with molecular formula C30H45NO23 and molecular weight 787.24 g/mol. IUPAC: 2-(hydroxymethyl)-6-[[5-hydroxy-6-(4-nitrophenoxy)-3,4-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]methoxy]oxane-3,4,5-triol.
Chemical Property Profile of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside
Property Insights of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside
The XLogP value of -7.7539 indicates that p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 379.97 Ų indicates high polarity, suggesting p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside has 13 hydrogen bond donor(s) and 23 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside?
The CAS number of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside is 1039067-33-8.
What is the molecular formula of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside?
The molecular formula of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside is C30H45NO23.
What is the molecular weight of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside?
The molecular weight of p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside is 787.24 g/mol.
Where can I buy p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside?
You can request a quote for p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside?
Yes, KEHONG BIO provides custom synthesis services for p-Nitrophenyl 3,4,6-Tri-O-(alpha-D-mannopyranosyl)-beta-D-mannopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.