Formula |
C13H19N2O9P |
IUPAC Name |
(2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]-2-methyl-butanedioic acid |
Molecular Mass |
378.272 g·mol−1 |
Heat of Formation |
-1951.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.92 ± 1.08 D |
Volume |
406.22 Å 3 |
Surface Area |
332.69 Å 2 |
HOMO Energy |
-9.24 ± 0.55 eV |
LUMO Energy |
-0.76 ± 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]-2-methyl-butanedioic acid
- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]-2-methyl-succinic acid
- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]-2-methylbutanedioic acid
- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]-2-methyl-butanedioic acid
- (2s)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]-2-methylbutanedioic acid
- 2-[(3-hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl)-amino]-2-methyl-succinic acid
- ama
- n-pyridoxyl-2-methylaspartic acid-5-monophosphate
- pla
|
InChIKey |
ZFKRUCNEKPIDBK-ZDUSSCGKSA-N |
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Elements |
P
C
H
O
N
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