Compound Details

 Compound-ID 8678
 Common Name Cob(II)yrinate a,c diamide
 Synonyms Cob(II)yrinate diamide
Cob(II)yrinic acid a,c-diamide
 InChI InChI=1S/C45H62N6O12.Co/c1-21-36-24(10-13-32(56)57)41(3,4)28(49-36)18-27-23(9-12-31(54)55)43(6,19-29(46)52)39(48-27)22(2)37-25(11-14-33(58)59)44(7,20-30(47)53)45(8,51-37)40-26(17-35(62)63)42(5,38(21)50-40)16-15-34(60)61;/h18,23-26,40H,9-17,19-20H2,1-8H3,(H10,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63);/q;+2/p-1/t23-,24-,25-,26+,40-,42-,43+,44+,45+;/m1./s1
 SMILES [H]C25(N=C(C(C)=C4N=C(C=C3N=C(C(C)=C1C(CCC(O)=O)C(C)(CC(N)=O)C2(C)(N1[Co+]))C(C)(CC(N)=O)C3(CCC(O)=O))C(C)(C)C4(CCC(O)=O))C(C)(CCC(O)=O)C5(CC(O)=O))
 External Links
 KEGG-COMPOUND-ID C06504
 PUBCHEM-ID 8735
 ChEBI-ID 27937


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