Tetrahydrobiopterin
2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one
Molecular Identity
Tetrahydrobiopterin
2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one
PubChem CID: 135402045
5,6,7,8-tetrahydrobiopterin is a member of biopterins, a diol and a tetrahydropterin. It has a role as a coenzyme, a prosthetic group, a nutraceutical and a human metabolite.
2D Structure
Properties
C9H15N5O3
Molecular Formula
241.25
Molecular Weight
g/mol
241.1175
Exact Mass
Da
-1.9
XLogP
Drug-like (Lipinski: < 5)
132
TPSA
Good oral absorption (< 140 A²)
6
H-Bond Donors
6
H-Bond Acceptors
405
Complexity
SMILES
Canonical SMILES
SMILES: CC(C(C1CNC2=C(N1)C(=O)NC(=N2)N)O)OIsomeric SMILES
SMILES: CC(C(C1CNC2=C(N1)C(=O)NC(=N2)N)O)OSynonyms(20)
tetrahydrobiopterin17528-72-25,6,7,8-tetrahydrobiopterin2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-oneCHEBI:15372DTXSID808724695,6,7,8-Tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone4(1H)-Pteridinone, 5,6,7,8-tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-Biopterin, 5,6,7,8-tetrahydro-RefChem:932804DTXCID208201262-Amino-6-(1,2-Dihydroxypropyl)-5,6,7,8-Tetrahydoro-4(1H)-Pteridinone2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4(3H)-pteridinone2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(1H)-one4(3H)-Pteridinone, 2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Tetrahydrobiopterin
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