PubChem6612121
Molecular Formula:
C42H46CoN4O16+
InChI: InChI=1/C42H47N4O16.Co/c1-41(17-39(59)60)23(5-9-35(51)52)29-14-27-21(11-37(55)56)19(3-7-33(47)48)25(43-27)13-26-20(4-8-34(49)50)22(12-38(57)58)28(44-26)15-31-42(2,18-40(61)62)24(6-10-36(53)54)30(46-31)16-32(41)45-29;/h13-16,19,21,23-24H,3-12,17-18H2,1-2H3,(H9,43,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62);/q-1;+3/p-1/b25-13-,31-15-;/fC42H46N4O16.Co/h47,49,51,53,55,57,59,61H;/q-2;m/b25-13-,29-14-,31-15-,32-16-;
InChIKey: InChIKey=HUYIZKRUKWRYSZ-IMCFGNHIDE
SMILES: CC1(C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(C(C(=N5)C=C1[N-]2)CCC(=O)O)(C)CC(=O)O)CC(=O)O)CCC(=O)O)C(C3CC(=O)O)CCC(=O)O)CCC(=O)O)CC(=O)O.[Co+3]
Names:
PubChem6612121
Registries:
PubChem CID 4489669
PubChem ID 6612121
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