2-azanyl-5-ethanoyl-6-[1,2,3-tris(oxidanyl)propyl]-1,4a,6,7-tetrahydropteridin-4-one

Systemtic Name: 2-azanyl-5-ethanoyl-6-[1,2,3-tris(oxidanyl)propyl]-1,4a,6,7-tetrahydropteridin-4-one Openeye Name: 5-acetyl-2-amino-6-(1,2,3-trihydroxypropyl)-1,4a,6,7-tetrahydropteridin-4-one CAS Name: 5-acetyl-2-amino-6-(1,2,3-trihydroxypropyl)-1,4a,6,7-tetrahydropteridin-4-one IUPAC Name: 5-acetyl-2-amino-6-(1,2,3-trihydroxypropyl)-1,4a,6,7-tetrahydropteridin-4-one Traditional Name: 5-acetyl-2-amino-6-(1,2,3-trihydroxypropyl)-1,4a,6,7-tetrahydropteridin-4-one Formula: C11H17N5O5 MolecularWeight: 299.28318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CN=C2C1C(=O)N=C(N2)N)C(C(CO)O)O

Isomeric SMILES

CC(=O)N1C(CN=C2C1C(=O)N=C(N2)N)C(C(CO)O)O

InChI

InChI=1S/C11H17N5O5/c1-4(18)16-5(8(20)6(19)3-17)2-13-9-7(16)10(21)15-11(12)14-9/h5-8,17,19-20H,2-3H2,1H3,(H3,12,13,14,15,21)