Tetrahydrobiopterin

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Formula C9H15N5O3
IUPAC Name (6r)-2-amino-6-[(1r,2s)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydro-1h-pteridin-4-one
Molecular Mass 241.247 g·mol−1
Heat of Formation -467.3 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 270.02 Å 3
Surface Area 241.15 Å 2
HOMO Energy -7.88 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-(6r)-2-amino-6-((1r,2s)-1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4(3h)-pteridinone
  • (6r)-2-amino-6-[(1r,2s)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydro-1h-pteridin-4-one
  • (6r,1'r,2's)-5,6,7,8 tetrahydrobiopterin
  • 6r-5,6,7,8-tetrahydrobiopterin
  • 6r-l-5,6,7,8-tetrahydrobiopterin
  • bcbcmap01_000204
  • sapropterin
  • smp1_000285
  • thb
CAS Number(s)
  • 62989-33-7
  • 27070-47-9
InChIKey FNKQXYHWGSIFBK-RPDRRWSUSA-N
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