| Formula |
C21H25N9O4 |
| IUPAC Name |
(2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-5-(methylamino)-5-oxo-pentanoic acid |
| Molecular Mass |
467.481 g·mol−1 |
| Heat of Formation |
-351.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
9.54 ± 1.08 D |
| Volume |
535.57 Å 3 |
| Surface Area |
474.74 Å 2 |
| HOMO Energy |
-8.56 ± 0.55 eV |
| LUMO Energy |
-1.25 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-5-keto-5-methylamino-valeric acid
- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-5-methylamino-5-oxo-pentanoic acid
- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]phenyl]carbonylamino]-5-methylamino-5-oxo-pentanoic acid
- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-methylamino-5-oxopentanoic acid
- (2s)-2-[[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]-5-methylamino-5-oxopentanoic acid
|
| InChIKey |
BOKUWBZDTDLPGM-AWEZNQCLSA-N |
| QR Code |
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| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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