1-Deoxy-1-(6-Methyl-2,4,7-Trioxo-1,3,4,7-Tetrahydro-8(2H)-Pteridinyl)-D-Ribitol

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Properties Simple | Detailed

Formula C12H16N4O7
IUPAC Name 6-methyl-8-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]-1h-pteridine-2,4,7-trione
Molecular Mass 328.278 g·mol−1
Heat of Formation -1190.8 ± 16.7 kJ·mol−1
Dipole Moment 6.33 ± 1.08 D
Volume 349.48 Å 3
Surface Area 311.59 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry C1
Synonyms
  • 6-methyl-8-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]-1h-pteridine-2,4,7-trione
  • 7-hydroxy-6-methyl-8-ribityl lumazine
InChIKey QCYVUUAIJUUUPI-BBVRLYRLSA-N
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