| Formula |
C27H27N7O8S |
| IUPAC Name |
(2s)-2-[[4-[[(2-amino-4-oxo-1h-pteridin-6-yl)methyl-(p-tolylsulfonyl)amino]methyl]benzoyl]amino]pentanedioic acid |
| Molecular Mass |
609.610 g·mol−1 |
| Heat of Formation |
-1036.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.56 ± 1.08 D |
| Volume |
677.42 Å 3 |
| Surface Area |
481.96 Å 2 |
| HOMO Energy |
-9.50 ± 0.55 eV |
| LUMO Energy |
-1.37 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MFBHBNCBSHCMEA-FQEVSTJZSA-O |
| QR Code |
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| Links |
ChemSpider
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| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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