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Retrosynthesis · AI + evidence

Tetrahydrobiopterin (C9H15N5O3)

Looking for routes to tetrahydrobiopterin? tetrahydrobiopterin presents a C9 framework, basic nitrogen. Use the planner with prefilled SMILES, or copy CC(O)C(O)C1CNc2[nH]c(N)nc(=O)c2N1 (CAS 17528-72-2).

Target
Tetrahydrobiopterin
CAS
17528-72-2
Formula
C9H15N5O3
Approx. MW
241.25
SMILES
CC(O)C(O)C1CNc2[nH]c(N)nc(=O)c2N1
PubChem CID
135402045
Approx. carbons
C9

Tetrahydrobiopterin structure

Properties

IUPAC name
2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one
Common names
tetrahydrobiopterin; 17528-72-2; 5,6,7,8-tetrahydrobiopterin; 2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-one; CHEBI:15372; DTXSID80872469; 5,6,7,8-Tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone; 4(1H)-Pteridinone, 5,6,7,8-tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-; Biopterin, 5,6,7,8-tetrahydro-; RefChem:932804
Molecular weight
241.25
Exact mass
241.12
InChIKey
FNKQXYHWGSIFBK-UHFFFAOYSA-N

View on PubChem

Tetrahydrobiopterin 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Tetrahydrobiopterin?

Tetrahydrobiopterin has molecular formula C9H15N5O3. Molecular weight about 241.25 g·mol⁻¹.

What is the CAS number of Tetrahydrobiopterin?

The CAS Registry Number for Tetrahydrobiopterin is 17528-72-2.

Run AI retrosynthesis for Tetrahydrobiopterin Target catalog AI tools overview

Open the planner with Tetrahydrobiopterin preloaded, then keep routes that match CAS 17528-72-2.

Related targets

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1-(methylsulfonyl)indoline3-(triethoxysilyl)propionitrile3-Aminopropyltriethoxysilane3-APDPO cpdCyclohexylisopropylamineDi-tert-butylcarbodiimide

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References & tools