Cobyrinic acid
Molecular Formula:
C45H59CoN4O14+
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;/h18,23-26,40H,9-17,19-20H2,1-8H3,(H8,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63);/q;+2/p-1/t23-,24-,25-,26+,40-,42-,43+,44+,45+;/m1./s1/fC45H59N4O14.Co/h50,52,54,56,58,60,62H;/q-1;m/b27-18-,36-21-,37-22-;
InChIKey: InChIKey=ZRAQEEAQQLYOBK-DLCJJUQGDG
SMILES: CC1=C2C(C(C([N-]2)(C3C(C(C(=N3)C(=C4C(C(C(=N4)C=C5C(C(C1=N5)(C)CC(=O)O)CCC(=O)O)(C)C)CCC(=O)O)C)(C)CCC(=O)O)CC(=O)O)C)(C)CC(=O)O)CCC(=O)O.[Co+2]
Names:
Cobyrinate
Cobyrinic acid
C05773
33593-50-9
Registries:
PubChem CID 11953856
PubChem ID 8068
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