MOLI000594

Molecular Formula: C₁₄H₂₀N₂O₄Tc

InChI: InChI=1/C14H20N2O4.Tc/c1-4-8(2)12(14(19)20)16-6-11-10(7-17)5-15-9(3)13(11)18;/h5-6,8,12,16-17H,4,7H2,1-3H3,(H,19,20);/b11-6+;/t8-,12-;/m0./s1/i;1+1/f/h19H;

InChIKey: InChIKey=ONIPBWVRHUCGJJ-OHHLWLPLHU
SMILES: CCC(C)C(C(=O)O)NC=C1C(=CN=C(C1=O)C)CO.[Tc]

Names:
    MOLI000594
    (2S,3S)-2-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-pyridin-4-ylidene]methyl]amino]-3-methyl-pentanoic acid; technetium

Registries:
    PubChem CID 5462023
    PubChem ID 581