Formula |
C12H17N2O9P |
IUPAC Name |
(2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]butanedioic acid |
Molecular Mass |
364.245 g·mol−1 |
Heat of Formation |
-1895.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.33 ± 1.08 D |
Volume |
389.67 Å 3 |
Surface Area |
340.2 Å 2 |
HOMO Energy |
-9.03 ± 0.55 eV |
LUMO Energy |
-0.38 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]butanedioic acid
- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]succinic acid
- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]butanedioic acid
- plp-asp
- pyridoxyl-aspartic acid-5-monophosphate
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InChIKey |
UKHLSCZNRCHWTM-VIFPVBQESA-N |
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Links |
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Elements |
P
C
H
O
N
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