Flavin Mononucleotide

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Properties Simple | Detailed

Formula C17H22N4O9P
IUPAC Name [(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-benzo[g]pteridine-1,5-diium-9a-id-10-yl)-2,3,4-trihydroxy-pentyl] dihydrogen phosphate
Molecular Mass 457.352 g·mol−1
Heat of Formation -1749.6 ± 16.7 kJ·mol−1
Dipole Moment 9.96 ± 1.08 D
Volume 476.07 Å 3
Surface Area 411.84 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -2.10 ± eV
Point Group Symmetry C1
Synonyms
  • 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2h)-yl)-5-o-phosphono-d-ribitol
  • [(2r,3s,4s)-5-(2,4-diketo-7,8-dimethyl-benzo[g]pteridin-10-yl)-2,3,4-trihydroxy-pentyl] dihydrogen phosphate
  • [(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-10-benzo[g]pteridinyl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
  • [(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-benzo[g]pteridin-10-yl)-2,3,4-trihydroxy-pentyl] dihydrogen phosphate
  • [(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
  • alloxazine mononucleotide
  • benzo[g]pteridine, riboflavin 5'-(dihydrogen phosphate) deriv.
  • d-ribitol, 1-deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2h)-yl)-, 5-(dihydrogen phosphate)
  • riboflavin 5'-(dihydrogen phosphate) (8ci,9ci)
  • riboflavine 5-phosphate (6ci)
InChIKey FVTCRASFADXXNN-SCRDCRAPSA-N
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