3-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]benzoic acid
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![3-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ad69985ce97b43e2aa56c8e0f8b4f8ea.png "3-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]benzoic acid")
3-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]benzoic acid
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CAS No:
63844-77-9
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Formula:
C15H17N2O7P
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Chemical Name:
3-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]benzoic acid
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Synonyms:
3-carboxyphenylpyridoxamine 5-phosphate;3-CPPAP;3-Carboxyphenylpyridoxamine 5-phosphate;3-[O-PHOSPHONOPYRIDOXYL]--AMINO-BENZOIC ACID;63844-77-9;PXG;3-Cppap;3-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]benzoic acid;DTXSID20213291;Q27464616;3-[[[2-Methyl-3-hydroxy-5-(phosphonooxymethyl)-4-pyridyl]methyl]amino]benzoic acid;Benzoic acid, 3-(((3-hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinyl)methyl)amino)-
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CAS No:
3-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]benzoic acid Basic Attributes
368.28 g/mol
368.07733788 g/mol
DTXSID20213291
Computed Properties
Molecular Weight:368.28
XLogP3:-0.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:368.07733788
Monoisotopic Mass:368.07733788
Topological Polar Surface Area:149
Heavy Atom Count:25
Complexity:500
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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