(6S,7R)-2-azanyl-5,6,7-trimethyl-5,6,7,8-tetrahydro-1H-pteridine-3,5-diium-4-one

Systemtic Name: (6S,7R)-2-azanyl-5,6,7-trimethyl-5,6,7,8-tetrahydro-1H-pteridine-3,5-diium-4-one Openeye Name: (6S,7R)-2-amino-5,6,7-trimethyl-5,6,7,8-tetrahydro-1H-pteridine-3,5-diium-4-one CAS Name: (6S,7R)-2-amino-5,6,7-trimethyl-5,6,7,8-tetrahydro-1H-pteridine-3,5-diium-4-one IUPAC Name: (6S,7R)-2-amino-5,6,7-trimethyl-5,6,7,8-tetrahydro-1H-pteridine-3,5-diium-4-one Traditional Name: (6S,7R)-2-amino-5,6,7-trimethyl-5,6,7,8-tetrahydro-1H-pteridine-3,5-diium-4-one Formula: C9H17N5O+2 MolecularWeight: 211.26418

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Descriptors Computed from Structure

Canonical SMILES:

CC1C([NH+](C2=C(N1)NC(=[NH+]C2=O)N)C)C

Isomeric SMILES

C[C@@H]1[C@@H]([NH+](C2=C(N1)NC(=[NH+]C2=O)N)C)C

InChI

InChI=1S/C9H15N5O/c1-4-5(2)14(3)6-7(11-4)12-9(10)13-8(6)15/h4-5H,1-3H3,(H4,10,11,12,13,15)/p+2/t4-,5+/m1/s1