Pyridoxal(5')diphospho(1)-glucose

Base Information

• Chemical Name: Pyridoxal(5')diphospho(1)-glucose
• CAS No.: 80503-46-4
• Molecular Formula: C14H21 N O14 P2 . 2 Na
• Molecular Weight: 513.26
• Mol file: 80503-46-4.mol

Synonyms:5-PDPG;pyridoxal(5')diphospho(1)-glucose

Chemical Property of Pyridoxal(5')diphospho(1)-glucose

Chemical Property:

• Vapor Pressure: 9.64E-29mmHg at 25°C
• Boiling Point: 823.9°C at 760 mmHg
• Flash Point: 452.1°C
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 9
• Exact Mass: 533.00761684
• Heavy Atom Count: 33
• Complexity: 694

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=NC=C(C(=C1O)C=O)COP(=O)([O-])OP(=O)([O-])OC2C(C(C(C(O2)CO)O)O)O.[Na+].[Na+]
• Isomeric 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+]