5'-Se-[(3S)-3-Amino-3-Carboxypropyl]-5'-Selenoadenosine

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Properties Simple | Detailed

Formula C14H20N6O5Se
IUPAC Name (2s)-2-amino-4-[[(2s,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylselanyl]butanoic acid
Molecular Mass 431.306 g·mol−1
Heat of Formation 709.1 ± 16.7 kJ·mol−1
Dipole Moment 3.83 ± 1.08 D
Volume 306.61 Å 3
Surface Area 245.02 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -3.39 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-4-[[(2s,3s,4r,5r)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methylseleno]butanoic acid
  • (2s)-2-amino-4-[[(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methylselanyl]butanoic acid
  • (2s)-2-amino-4-[[(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylselanyl]butanoic acid
  • (2s)-2-amino-4-[[(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylseleno]butyric acid
  • s-adenosyl-l-homoselenocysteine
  • sai
InChIKey UVSMMLABJBJNGH-WFMPWKQPSA-N
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