PXP

PYRIDOXINE-5'-PHOSPHATE

Created:	2000-12-12
Last modified:	2024-09-27

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4 entries where PXP is found as a standalone ligand1 entries where PXP is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	28
Aromatic Bond Count	6

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Chemical Component Summary
Name	PYRIDOXINE-5'-PHOSPHATE
Systematic Name (OpenEye OEToolkits)	[5-hydroxy-4-(hydroxymethyl)-6-methyl-pyridin-3-yl]methyl dihydrogen phosphate
Formula	C₈ H₁₂ N O₆ P
Molecular Weight	249.158
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=P(O)(O)OCc1cnc(c(O)c1CO)C
SMILES	CACTVS	3.341	Cc1ncc(CO[P](O)(O)=O)c(CO)c1O
SMILES	OpenEye OEToolkits	1.5.0	Cc1c(c(c(cn1)COP(=O)(O)O)CO)O
Canonical SMILES	CACTVS	3.341	Cc1ncc(CO[P](O)(O)=O)c(CO)c1O
Canonical SMILES	OpenEye OEToolkits	1.5.0	Cc1c(c(c(cn1)COP(=O)(O)O)CO)O
InChI	InChI	1.03	InChI=1S/C8H12NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2,10-11H,3-4H2,1H3,(H2,12,13,14)
InChIKey	InChI	1.03	WHOMFKWHIQZTHY-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB02209
Name	Pyridoxine phosphate
Groups	experimental
Synonyms	Pyridoxine phosphate Pyridoxine 5-phosphate
Categories	Coenzymes Enzymes and Coenzymes Picolines Pyridines Vitamin B Complex Vitamins
CAS number	447-05-2

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Pyridoxine 5'-phosphate synthase	MAELLLGVNIDHIATLRNARGTAYPDPVQAAFIAEQAGADGITVHLREDR...	unknown
Ornithine decarboxylase	MNNFGNEEFDCHFLDEGFTAKDILDQKINEVSSSDDKDAFYVADLGDILK...	unknown
Pyridoxine-5'-phosphate oxidase	MTCWLRGVTATFGRPAEWPGYLSHLCGRSAAMDLGPMRKSYRGDREAFEE...	unknown	substrate
Pyridoxine 5'-phosphate phosphatase	MKKLDRMPTHAEFAHVTDWVFDLDNTLYPHHVNLFSQIDRNMTAYVAELL...	unknown	substrate

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682