NSC44037

Molecular Formula: C₁₆H₁₅N₇O₆

InChI: InChI=1/C16H15N7O6/c17-16-19-12-11(14(27)20-16)21-23(22-12)8-3-1-7(2-4-8)13(26)18-9(15(28)29)5-6-10(24)25/h1-4,9H,5-6H2,(H,18,26)(H,24,25)(H,28,29)(H3,17,19,20,22,27)/f/h18,22,24,28H,17H2

InChIKey: InChIKey=PZCBWFSIGBZHGN-RCCYWTPRCZ
SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)N2NC3=NC(=NC(=O)C3=N2)N

Names:
    NSC44037
    2-[[4-(3-amino-5-oxo-2,4,7,8,9-pentazabicyclo[4.3.0]nona-1,3,6-trien-8-yl)benzoyl]amino]pentanedioic acid
    6329-09-5

Registries:
    PubChem CID 239198
    PubChem ID 98306