1-{6-[(2R)-1-Carboxy-2-Tridecanyl]-7,8-Dimethyl-2,4-Dioxo-1,2,3,4-Tetrahydrobenzo[G]Pteridin-10-Ium-10-Yl}-1-Deoxy-5-O-Phosphono-D-Ribitol

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Properties Simple | Detailed

Formula C31H48N4O11P+
IUPAC Name 3-[7,8-dimethyl-2,4-dioxo-10-(2,3,4-trihydroxy-5-phosphonatooxy-pentyl)-1,10a-dihydrobenzo[g]pteridin-6-yl]tetradecanoate
Molecular Mass 683.707 g·mol−1
Heat of Formation 1994.7 ± 16.7 kJ·mol−1
Dipole Moment 8.73 ± 1.08 D
Volume 663.71 Å 3
Surface Area 546.16 Å 2
Point Group Symmetry C1
Synonyms
  • (3r)-3-[2,4-diketo-7,8-dimethyl-10-[(2s,3s,4r)-2,3,4-trihydroxy-5-phosphonooxy-pentyl]-1h-benzo[g]pteridin-10-ium-6-yl]myristic acid
  • (3r)-3-[7,8-dimethyl-2,4-dioxo-10-[(2s,3s,4r)-2,3,4-trihydroxy-5-phosphonooxy-pentyl]-1h-benzo[g]pteridin-10-ium-6-yl]tetradecanoic acid
InChIKey XATUXKKNCYJFKK-QPLRPWAESA-O
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