Cobalt-precorrin 5
Molecular Formula:
C45H53CoN4O16+
InChI: InChI=1/C45H54N4O16.Co/c1-21-45-40-26(15-37(60)61)41(2,13-12-35(56)57)30(47-40)16-27-22(6-9-32(50)51)25(14-36(58)59)44(5,48-27)18-29-23(7-10-33(52)53)42(3,19-38(62)63)31(46-29)17-28(49-45)24(8-11-34(54)55)43(45,4)20-39(64)65-21;/h16-17,21,24,26H,6-15,18-20H2,1-5H3,(H8,46,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63);/q;+2/p-1/b30-16-;/t21u,24-,26u,41-,42+,43+,44+,45?;/m1./s1/fC45H53N4O16.Co/h50,52,54,56,58,60,62H;/q-1;m/b30-16-,31-17-;
InChIKey: InChIKey=CVGZOJYWJUZMIJ-GEROBPAKDR
SMILES: CC1C23C4=NC(=CC5=NC(CC6=C(C(C(=CC(=N2)C(C3(CC(=O)O1)C)CCC(=O)O)[N-]6)(C)CC(=O)O)CCC(=O)O)(C(=C5CCC(=O)O)CC(=O)O)C)C(C4CC(=O)O)(C)CCC(=O)O.[Co+2]
Names:
Cobalt-precorrin 5
C11541
Registries:
PubChem CID 5281936
PubChem ID 13708
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