Formula |
C19H20N8O5 |
IUPAC Name |
(2s)-2-[[4-[(2,4-diaminopteridine-1,3,5,8-tetraium-6-yl)methylamino]benzoyl]amino]pentanedioic acid |
Molecular Mass |
440.413 g·mol−1 |
Heat of Formation |
-551.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.71 ± 1.08 D |
Volume |
492.56 Å 3 |
Surface Area |
445.42 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
-1.29 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]glutaric acid
- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
- (2s)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid
- (2s)-2-[[[4-[(2,4-diamino-6-pteridinyl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid
- 58602-66-7 (disodium salt)
- l-glutamic acid, n-[4-[[(2,4-diamino-6-pteridinyl)methyl]amino]benzoyl]-
- n-(4-{[(2,4-diaminopteridin-6-yl)methyl]amino}benzoyl)-l-glutamic acid
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InChIKey |
TVZGACDUOSZQKY-LBPRGKRZSA-N |
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Elements |
H
C
O
N
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