MOLI000593

Molecular Formula: C₁₃H₁₈N₂O₄Tc

InChI: InChI=1/C13H18N2O4.Tc/c1-7(2)11(13(18)19)15-5-10-9(6-16)4-14-8(3)12(10)17;/h4-5,7,11,15-16H,6H2,1-3H3,(H,18,19);/b10-5+;/t11-;/m0./s1/i;1+1/f/h18H;

InChIKey: InChIKey=MRJYWNIEEMCJIF-FCQSAVDJHL
SMILES: CC1=NC=C(C(=CNC(C(C)C)C(=O)O)C1=O)CO.[Tc]

Names:
    MOLI000593
    (2S)-2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-pyridin-4-ylidene]methyl]amino]-3-methyl-butanoic acid; technetium

Registries:
    PubChem CID 5462021
    PubChem ID 580