2-azanyl-6-[(1S,2R)-1,2,3-tris(oxidanyl)propyl]-4a,7-dihydro-1H-pteridin-4-one

Systemtic Name: 2-azanyl-6-[(1S,2R)-1,2,3-tris(oxidanyl)propyl]-4a,7-dihydro-1H-pteridin-4-one Openeye Name: 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-4a,7-dihydro-1H-pteridin-4-one CAS Name: 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-4a,7-dihydro-1H-pteridin-4-one IUPAC Name: 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-4a,7-dihydro-1H-pteridin-4-one Traditional Name: 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-4a,7-dihydro-1H-pteridin-4-one Formula: C9H13N5O4 MolecularWeight: 255.23062

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2C(=N1)NC(=NC2=O)N)C(C(CO)O)O

Isomeric SMILES

C1C(=NC2C(=N1)NC(=NC2=O)N)[C@@H]([C@@H](CO)O)O

InChI

InChI=1S/C9H13N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h4-6,15-17H,1-2H2,(H3,10,11,13,14,18)/t4-,5?,6+/m1/s1