PubChem15411694

Molecular Formula: C₄₅H₆₀CoN₄O₁₄⁺³

InChI: InChI=1/C45H60N4O14.Co/c1-21-36-24(10-13-30(52)53)41(3,4)28(47-36)18-27-23(9-12-29(50)51)43(6,19-34(60)61)39(46-27)22(2)37-25(11-14-31(54)55)44(7,20-35(62)63)45(8,49-37)40-26(17-33(58)59)42(5,38(21)48-40)16-15-32(56)57;/h18,23-26,40,46H,9-17,19-20H2,1-8H3,(H,50,51)(H,52,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61)(H,62,63);/q;+3/b27-18-,36-21-,39-22-;/t23-,24-,25-,26+,40-,42-,43+,44+,45+;/m1./s1/f/h50,52,54,56,58,60,62H;

InChIKey: InChIKey=DMGHNDOEFQFWPD-KOQULIAWDH
SMILES: CC1=C2C(C(C(=N2)C=C3C(C(C(=C(C4=NC(C5C(C(C1=N5)(C)CCC(=O)O)CC(=O)O)(C(C4CCC(=O)O)(C)CC(=O)O)C)C)N3)(C)CC(=O)O)CCC(=O)O)(C)C)CCC(=O)O.[Co+3]

Names:
    PubChem15411694

Registries:
    PubChem CID 10396075
    PubChem ID 15411694