4-[[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]butanoic acid
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![4-[[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ab1308c77acf4794abf56164305ac90f.png "4-[[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]butanoic acid")
4-[[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]butanoic acid
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CAS No:
63221-68-1
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Formula:
C12H17N2O7P
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Chemical Name:
4-[[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]butanoic acid
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Synonyms:
Butanoic acid,4-(((3-hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinyl)methylene)amino); GABA-pyridoxal phosphate; Pyridoxal phosphate GABA;
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CAS No:
4-[[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]butanoic acid Basic Attributes
332.24600
332.07733788 g/mol
Computed Properties
Molecular Weight:332.25
XLogP3:-1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:332.07733788
Monoisotopic Mass:332.07733788
Topological Polar Surface Area:150
Heavy Atom Count:22
Complexity:439
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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