N-Acetylglucosaminylphosphorylundecaprenol structure

N-Acetylglucosaminylphosphorylundecaprenol

TL;DR: N-Acetylglucosaminylphosphorylundecaprenol (CAS 72165-46-9) is a chemical compound with molecular formula C63H104NO9P and molecular weight 1049.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] hydrogen phosphate

Also Known As: Glcnac-P-undecaprenol, N-Acetylglucosaminylphosphorylundecaprenol, N-Acetylglucosaminyl monophosphorylundecaprenol, [(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] hydrogen phosphate, beta-D-Glucopyranose, 2-(acetylamino)-2-deoxy-, 1-(3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetracontaundecaenyl hydrogen phosphate)

CAS: 72165-46-9
Molecular Formula C63H104NO9P
Molecular Weight 1049.74 g/mol
LogP 16.2949
Topological Polar Surface Area 154.78 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 8
Rotatable Bonds 37
Exact Mass 1049.7449
Heavy Atoms 74
Complexity 2056.5752

Chemical Identifiers

CAS Number 72165-46-9
SMILES CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COP(=O)(O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)/C)/C)/C)/C)/C)/C)/C)/C)/C)/C)C

Product Overview

N-Acetylglucosaminylphosphorylundecaprenol (CAS 72165-46-9), with molecular formula C63H104NO9P and molecular weight 1049.74 g/mol. IUPAC: [(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] hydrogen phosphate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N-Acetylglucosaminylphosphorylundecaprenol

XLogP
16.2949
TPSA (Topological Polar Surface Area)
154.78
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
8
Rotatable Bonds
37
Heavy Atoms
74
Complexity
2056.5752
Exact Mass
1049.7449
Monoisotopic Mass
1049.7449
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-Acetylglucosaminylphosphorylundecaprenol

The XLogP value of 16.2949 indicates that N-Acetylglucosaminylphosphorylundecaprenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 154.78 Ų indicates high polarity, suggesting N-Acetylglucosaminylphosphorylundecaprenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Acetylglucosaminylphosphorylundecaprenol has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N-Acetylglucosaminylphosphorylundecaprenol?

The CAS number of N-Acetylglucosaminylphosphorylundecaprenol is 72165-46-9.

What is the molecular formula of N-Acetylglucosaminylphosphorylundecaprenol?

The molecular formula of N-Acetylglucosaminylphosphorylundecaprenol is C63H104NO9P.

What is the molecular weight of N-Acetylglucosaminylphosphorylundecaprenol?

The molecular weight of N-Acetylglucosaminylphosphorylundecaprenol is 1049.74 g/mol.

Where can I buy N-Acetylglucosaminylphosphorylundecaprenol?

You can request a quote for N-Acetylglucosaminylphosphorylundecaprenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N-Acetylglucosaminylphosphorylundecaprenol?

Yes, KEHONG BIO provides custom synthesis services for N-Acetylglucosaminylphosphorylundecaprenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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