5'-S-(3-Aminopropyl)-5'-Thioadenosine

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Properties Simple | Detailed

Formula C13H20N6O3S
IUPAC Name (2s,3s,4r,5r)-2-(3-aminopropylsulfanylmethyl)-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol
Molecular Mass 340.401 g·mol−1
Heat of Formation -292.1 ± 16.7 kJ·mol−1
Dipole Moment 1.56 ± 1.08 D
Volume 385.53 Å 3
Surface Area 342.51 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4r,5r)-2-(3-aminopropylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol
  • (2s,3s,4r,5r)-2-(3-aminopropylsulfanylmethyl)-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol
  • (2s,3s,4r,5r)-2-[(3-aminopropylthio)methyl]-5-(6-amino-9-purinyl)tetrahydrofuran-3,4-diol
  • (2s,3s,4r,5r)-2-[(3-aminopropylthio)methyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol
  • adenosine, 5'-s-(3-aminopropyl)-5'-thio-
  • s-adenosyl-3-thiopropylamine
CAS Number(s)
  • 53186-57-5
InChIKey FUSRAALGPJJIRO-QYVSTXNMSA-N
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