MOLI000945

Molecular Formula: C22H36IN8O13Tc-


InChI: InChI=1/C22H36IN8O12.O.Tc/c24-31-15(2-4-20(39)40)22(42)30-10-17(35)27-8-13(33)7-25-14(1-3-19(37)38)21(41)29-11-18(36)28-9-16(34)26-6-12(32)5-23-43;;/h14-15,25,31,43H,1-11,24H2,(H,26,34)(H,27,35)(H,28,36)(H,29,41)(H,30,42)(H,37,38)(H,39,40);;/q-1;;/t14-,15-;;/m0../s1/i;;1+1/f/h26-30,37,39H;;/rC22H36IN8O12.OTc/c24-31-15(2-4-20(39)40)22(42)30-10-17(35)27-8-13(33)7-25-14(1-3-19(37)38)21(41)29-11-18(36)28-9-16(34)26-6-12(32)5-23-43;1-2/h14-15,25,31,43H,1-11,24H2,(H,26,34)(H,27,35)(H,28,36)(H,29,41)(H,30,42)(H,37,38)(H,39,40);/q-1;/t14-,15-;/m0./s1/i;2+1/f/h26-30,37,39H;

InChIKey: InChIKey=MWETUDCPDKIEIU-CBDFSFNGHJ
SMILES: C(CC(=O)O)C(C(=O)NCC(=O)NCC(=O)NCC(=O)C[I-]O)NCC(=O)CNC(=O)CNC(=O)C(CCC(=O)O)NN.O=[Tc]

Names:
    MOLI000945

Registries:
    PubChem CID 6398949
    PubChem ID 923