Pyridoxal(5')diphospho(1)-glucose
TL;DR: Pyridoxal(5')diphospho(1)-glucose (CAS 80503-46-4) is a chemical compound with molecular formula C14H19NNa2O14P2 and molecular weight 533.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;[(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy-oxidophosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate
Also Known As: 5-Pdpg, Pyridoxal(5')diphospho(1)-glucose, alpha-D-Glucopyranose, 1-(P'-((4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl) dihydrogen diphosphate), disodium salt, Disodium;[(4-formyl-5-hydroxy-6-methylpyridin-3-yl)methoxy-oxidophosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate, a-D-Glucopyranose,1-[P'-[(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl] dihydrogendiphosphate], disodium salt (9CI)
| Molecular Formula | C14H19NNa2O14P2 |
|---|---|
| Molecular Weight | 533.01 g/mol |
| LogP | -8.79738 |
| Topological Polar Surface Area | 248.29 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 9 |
| Exact Mass | 533.0076 |
| Heavy Atoms | 33 |
| Complexity | 904.8935 |
Chemical Identifiers
| CAS Number | 80503-46-4 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C=O)COP(=O)([O-])OP(=O)([O-])O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O.[Na+].[Na+] |
Product Overview
Pyridoxal(5')diphospho(1)-glucose (CAS 80503-46-4), with molecular formula C14H19NNa2O14P2 and molecular weight 533.01 g/mol. IUPAC: disodium;[(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy-oxidophosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate.
Chemical Property Profile of Pyridoxal(5')diphospho(1)-glucose
Property Insights of Pyridoxal(5')diphospho(1)-glucose
The XLogP value of -8.79738 indicates that Pyridoxal(5')diphospho(1)-glucose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.29 Ų indicates high polarity, suggesting Pyridoxal(5')diphospho(1)-glucose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyridoxal(5')diphospho(1)-glucose has 5 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridoxal(5')diphospho(1)-glucose?
The CAS number of Pyridoxal(5')diphospho(1)-glucose is 80503-46-4.
What is the molecular formula of Pyridoxal(5')diphospho(1)-glucose?
The molecular formula of Pyridoxal(5')diphospho(1)-glucose is C14H19NNa2O14P2.
What is the molecular weight of Pyridoxal(5')diphospho(1)-glucose?
The molecular weight of Pyridoxal(5')diphospho(1)-glucose is 533.01 g/mol.
Where can I buy Pyridoxal(5')diphospho(1)-glucose?
You can request a quote for Pyridoxal(5')diphospho(1)-glucose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridoxal(5')diphospho(1)-glucose?
Yes, KEHONG BIO provides custom synthesis services for Pyridoxal(5')diphospho(1)-glucose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.