5'-O-{Hydroxy[3-(4-Hydroxyphenyl)Propoxy]Phosphoryl}Adenosine

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Properties Simple | Detailed

Formula C19H24N5O8P
IUPAC Name [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 3-(4-hydroxyphenyl)propyl hydrogen phosphate
Molecular Mass 481.396 g·mol−1
Heat of Formation -1446.5 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 514.06 Å 3
Surface Area 361.66 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
InChIKey AWKHKUUJFJBBRQ-NVQRDWNXSA-N
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