Formula |
C22H21N7O6 |
IUPAC Name |
(2s)-2-[[4-[(2-amino-4-oxo-pteridin-1-ium-3-id-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]pentanedioic acid |
Molecular Mass |
479.445 g·mol−1 |
Heat of Formation |
-456.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.06 ± 1.08 D |
Volume |
528.25 Å 3 |
Surface Area |
443.98 Å 2 |
HOMO Energy |
-8.68 ± 0.55 eV |
LUMO Energy |
-1.38 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-2-[[4-[(2-amino-4-keto-1h-pteridin-6-yl)methyl-propargyl-amino]benzoyl]amino]glutaric acid
- (2s)-2-[[4-[(2-amino-4-oxo-1h-pteridin-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]pentanedioic acid
- (2s)-2-[[4-[(2-amino-4-oxo-1h-pteridin-6-yl)methyl-prop-2-ynyl-amino]phenyl]carbonylamino]pentanedioic acid
- (2s)-2-[[4-[(2-amino-4-oxo-1h-pteridin-6-yl)methyl-prop-2-ynylamino]benzoyl]amino]pentanedioic acid
- (2s)-2-[[[4-[(2-amino-4-oxo-1h-pteridin-6-yl)methyl-prop-2-ynylamino]phenyl]-oxomethyl]amino]pentanedioic acid
- l-glutamic acid, n-(4-(((2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl)-2-propylamino)benzoyl)-
- l-glutamic acid, n-(4-(((2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl)-2-propynylamino)benzoyl)-
- n(10)-propargylfolic acid
- n-(4-(((2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl)-2-propynylamino)benzoyl)-l-glutamic acid
|
CAS Number(s) |
|
InChIKey |
SQJGTVKPWANJGI-HNNXBMFYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
N
|
|
|