5'-O-(L-Histidylsulfamoyl)Adenosine

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Properties Simple | Detailed

Formula C16H21N9O7S
IUPAC Name [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl n-[(2s)-2-amino-3-(1h-imidazol-5-yl)propanoyl]sulfamate
Molecular Mass 483.459 g·mol−1
Heat of Formation -886.2 ± 16.7 kJ·mol−1
Dipole Moment 6.94 ± 1.08 D
Volume 502.6 Å 3
Surface Area 359.64 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
InChIKey WRXPXUSZYDNAQP-LEJQEAHTSA-N
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