5'-{[(3S)-3-Amino-3-Carboxypropyl]Amino}-5'-Deoxyadenosine

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Properties Simple | Detailed

Formula C14H21N7O5
IUPAC Name (2s)-2-amino-4-[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylamino]butanoic acid
Molecular Mass 367.360 g·mol−1
Heat of Formation -707.4 ± 16.7 kJ·mol−1
Dipole Moment 1.15 ± 1.08 D
Volume 407.44 Å 3
Surface Area 317.23 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
InChIKey WSOGVCAFRBSBRE-WFMPWKQPSA-N
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