CHEBI:60062 - cobalt-precorrin-5A(7−)

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ChEBI Name cobalt-precorrin-5A(7−)
ChEBI ID CHEBI:60062
ChEBI ASCII Name cobalt-precorrin-5A(7-)
Definition A precorrin carboxylic acid anion obtained by deprotonation of the carboxy groups of cobalt-precorrin-5A; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C45H45CoN4O16
Net Charge -7
Average Mass 956.78920
Monoisotopic Mass 956.22009
InChI InChI=1S/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;/h16-17,21,24H,6-15,18-20H2,1-5H3,(H9,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63);/q;+2/p-9/t21?,24-,41-,42+,43+,44+,45?;/m1./s1
InChIKey FMPRUTAGAUSVOA-IBAGIMPYSA-E
SMILES CC1OC(=O)C[C@@]2(C)[C@H](CCC([O-])=O)C3=CC4=[N+]5C(C[C@]6(C)N7C(=CC8=[N+]9C(=C(CC([O-])=O)[C@@]8(C)CCC([O-])=O)C12N3[Co--]579)C(CCC([O-])=O)=C6CC([O-])=O)=C(CCC([O-])=O)[C@]4(C)CC([O-])=O
ChEBI Ontology
Outgoing cobalt-precorrin-5A(7−) (CHEBI:60062) is a precorrin carboxylic acid anion (CHEBI:59140)
cobalt-precorrin-5A(7−) (CHEBI:60062) is conjugate base of cobalt-precorrin-5A (CHEBI:52488)
Incoming cobalt-precorrin-5A (CHEBI:52488) is conjugate acid of cobalt-precorrin-5A(7−) (CHEBI:60062)
Synonym Source
Co-precorrin-5A UniProt
Last Modified
28 July 2017