3'-O-L-Phenylalanyladenosine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C19H23N6O8P
IUPAC Name [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] (2s)-2-amino-3-phenyl-propanoate
Molecular Mass 494.395 g·mol−1
Heat of Formation -1386.2 ± 16.7 kJ·mol−1
Dipole Moment 2.16 ± 1.08 D
Volume 532.13 Å 3
Surface Area 450.83 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
InChIKey DITNEQHUTYSTHA-URQYDQELSA-N
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