Formula |
C35H42N8O15 |
IUPAC Name |
2-[[4-[[4-[[4-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid |
Molecular Mass |
814.753 g·mol−1 |
Heat of Formation |
1790.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
14.65 ± 1.08 D |
Volume |
840.1 Å 3 |
Surface Area |
590.33 Å 2 |
HOMO Energy |
-8.88 ± 0.55 eV |
LUMO Energy |
-3.83 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
DICHBVJYDUDAIQ-KJJMTIBFSA-N |
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Elements |
C
O
N
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