2-azanyl-1-(1-oxidanyl-2-oxidanylidene-propyl)-2,3,4a,5-tetrahydropteridin-4-one

Systemtic Name: 2-azanyl-1-(1-oxidanyl-2-oxidanylidene-propyl)-2,3,4a,5-tetrahydropteridin-4-one Openeye Name: 2-amino-1-(1-hydroxy-2-oxo-propyl)-2,3,4a,5-tetrahydropteridin-4-one CAS Name: 2-amino-1-(1-hydroxy-2-oxopropyl)-2,3,4a,5-tetrahydropteridin-4-one IUPAC Name: 2-amino-1-(1-hydroxy-2-oxopropyl)-2,3,4a,5-tetrahydropteridin-4-one Traditional Name: 2-amino-1-(1-hydroxy-2-keto-propyl)-2,3,4a,5-tetrahydropteridin-4-one Formula: C9H13N5O3 MolecularWeight: 239.23122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(N1C(NC(=O)C2C1=NC=CN2)N)O

Isomeric SMILES

CC(=O)C(N1C(NC(=O)C2C1=NC=CN2)N)O

InChI

InChI=1S/C9H13N5O3/c1-4(15)8(17)14-6-5(11-2-3-12-6)7(16)13-9(14)10/h2-3,5,8-9,11,17H,10H2,1H3,(H,13,16)