2'-Deoxy-2'-(L-Valylamino)Adenosine

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Properties Simple | Detailed

Formula C15H23N7O4
IUPAC Name (2s)-2-amino-n-[(2r,3r,4s,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-3-methyl-butanamide
Molecular Mass 365.388 g·mol−1
Heat of Formation -516.5 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 425.3 Å 3
Surface Area 362.04 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-n-[(2r,3r,4s,5r)-2-(6-amino-9-purinyl)-4-hydroxy-5-(hydroxymethyl)-3-tetrahydrofuranyl]-3-methylbutanamide
  • (2s)-2-amino-n-[(2r,3r,4s,5r)-2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-3-methyl-butanamide
  • (2s)-2-amino-n-[(2r,3r,4s,5r)-2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-3-methyl-butanamide
  • (2s)-2-amino-n-[(2r,3r,4s,5r)-2-(6-aminopurin-9-yl)-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]-3-methyl-butyramide
  • 2'-(l-valyl)amino-2'-deoxyadenosine
  • 2va
InChIKey UPIKYXOKKJTWAH-QNNFVPKKSA-N
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