5-Deoxy-5-[8-(Hydroxymethyl)-7-Methyl-2,4-Dioxo-3,4-Dihydrobenzo[G]Pteridin-10(2H)-Yl]-D-Ribitol

Molecule SVG Image

Properties Simple | Detailed

Formula C17H21N4O7++
IUPAC Name 8-(hydroxymethyl)-7-methyl-10-[(2r,3r,4s)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridin-10a-ylium-1-ide-2,4-dione
Molecular Mass 393.371 g·mol−1
Heat of Formation -1065.3 ± 16.7 kJ·mol−1
Dipole Moment 8.22 ± 1.08 D
Volume 424.19 Å 3
Surface Area 352.65 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -2.25 ± eV
Point Group Symmetry C1
Synonyms
  • 7-methyl-8-methylol-10-[(2r,3r,4s)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-quinone
  • 8-(hydroxymethyl)-7-methyl-10-[(2r,3r,4s)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione
  • 8-hydroxymethylriboflavin
  • 8alpha-hydroxyriboflavin
  • riboflavin, alpha8-hydroxy-
CAS Number(s)
  • 52134-62-0
InChIKey GZKQMBNNNFCACH-MBNYWOFBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N