Succinyladenosine

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Properties Simple | Detailed

Formula C14H17N5O8
IUPAC Name (2s)-2-[[9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purine-1,3,7-triium-6-yl]amino]butanedioic acid
Molecular Mass 383.313 g·mol−1
Heat of Formation -1203.3 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 409.68 Å 3
Surface Area 360.95 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-6-purinyl]amino]butanedioic acid
  • (2s)-2-[[9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]butanedioic acid
  • (2s)-2-[[9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]butanedioic acid
  • (2s)-2-[[9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]purin-6-yl]amino]succinic acid
InChIKey VKGZCEJTCKHMRL-VWJPMABRSA-N
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