2-azanyl-6-[(1S,2S,3S)-1,2,3-tris(oxidanyl)butyl]-4aH-pteridin-4-one

Systemtic Name: 2-azanyl-6-[(1S,2S,3S)-1,2,3-tris(oxidanyl)butyl]-4aH-pteridin-4-one Openeye Name: 2-amino-6-[(1S,2S,3S)-1,2,3-trihydroxybutyl]-4aH-pteridin-4-one CAS Name: 2-amino-6-[(1S,2S,3S)-1,2,3-trihydroxybutyl]-4aH-pteridin-4-one IUPAC Name: 2-amino-6-[(1S,2S,3S)-1,2,3-trihydroxybutyl]-4aH-pteridin-4-one Traditional Name: 2-amino-6-[(1S,2S,3S)-1,2,3-trihydroxybutyl]-4aH-pteridin-4-one Formula: C10H13N5O4 MolecularWeight: 267.24132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C1=NC2C(=NC(=NC2=O)N)N=C1)O)O)O

Isomeric SMILES

C[C@@H]([C@@H]([C@H](C1=NC2C(=NC(=NC2=O)N)N=C1)O)O)O

InChI

InChI=1S/C10H13N5O4/c1-3(16)6(17)7(18)4-2-12-8-5(13-4)9(19)15-10(11)14-8/h2-3,5-7,16-18H,1H3,(H2,11,15,19)/t3-,5?,6-,7-/m0/s1