CLA

Molecular Formula: C55H72MgN4O5-2


InChI: InChI=1/C55H73N4O5.Mg/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42;/h13,26,28-33,37,41,51H,1,14-25,27H2,2-12H3,(H-,58,59,61);/q-3;+2/p-1/b34-26+,43-29-,44-28-,47-30-;/t32-,33+,37+,41+,51-;/m1./s1/fC55H72N4O5.Mg/q-4;m/b34-26+,43-29-,44-28-,47-30-,52-50-;

InChIKey: InChIKey=FSJGTKJYMINVDL-DUOCWHLPDW
SMILES: CCC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(C(C(=C5C(C(=O)C6=C5[N-]C(=C6C)C=C1[N-]2)C(=O)OC)[N-]4)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C)C=C)C.[Mg+2]

Names:
    CLA

Registries:
    PubChem CID 11987754
    PubChem ID 11532220