N-[3-(1,3-Dimethyl-2,6-Dioxo-2,3,6,7-Tetrahydro-1H-Purin-8-Yl)Propyl]-2-Oxo-7-(β-D-Talopyranosyloxy)-2H-Chromene-3-Carboxamide

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Properties Simple | Detailed

Formula C26H29N5O11
IUPAC Name n-[3-(1,3-dimethyl-2,6-dioxo-7h-purin-8-yl)propyl]-2-oxo-7-[(2s,3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-3-carboxamide
Molecular Mass 587.535 g·mol−1
Heat of Formation -1734.8 ± 16.7 kJ·mol−1
Dipole Moment 5.88 ± 1.08 D
Volume 627.27 Å 3
Surface Area 428.05 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
InChIKey PSHIXQHKZSNFIT-ULUOIHDKSA-N
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