CHEBI:70791 - cobalt-precorrin-7(7−)

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ChEBI Name cobalt-precorrin-7(7−) ChEBI ID CHEBI:70791 ChEBI ASCII Name cobalt-precorrin-7(7-) Definition A precorrin carboxylic acid anion obtained by global deprotonation of the carboxy groups of cobalt-precorrin-7. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information ChemicalBook:CB4297527, ZINC000002242980 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C44H50CoN4O14 Net Charge -6 Average Mass 917.81940 Monoisotopic Mass 917.26884 InChI InChI=1S/C44H58N4O14.Co/c1-21-37-23(8-11-30(49)50)22(2)43(6,48-37)18-28-24(9-12-31(51)52)41(4,19-35(59)60)29(45-28)17-27-25(10-13-32(53)54)42(5,20-36(61)62)44(7,47-27)39-26(16-34(57)58)40(3,38(21)46-39)15-14-33(55)56;/h17,21,25-26,39H,8-16,18-20H2,1-7H3,(H8,45,47,49,50,51,52,53,54,55,56,57,58,59,60,61,62);/q;+2/p-8/t21?,25-,26+,39-,40-,41+,42+,43+,44+;/m1./s1 InChIKey GPKQHTAVLDBECX-HDPLZVLRSA-F SMILES [H][C@]12[C@H](CC([O-])=O)[C@@](C)(CCC([O-])=O)C3=[N+]1[Co--]14N5C(=CC6=[N+]1C(C[C@@]1(C)C(C)=C(CCC([O-])=O)C(C3C)=[N+]41)=C(CCC([O-])=O)[C@]6(C)CC([O-])=O)[C@@H](CCC([O-])=O)[C@](C)(CC([O-])=O)[C@]25C ChEBI Ontology Outgoing cobalt-precorrin-7(7−) (CHEBI:70791) is a precorrin carboxylic acid anion (CHEBI:59140) cobalt-precorrin-7(7−) (CHEBI:70791) is conjugate base of cobalt-precorrin-7 (CHEBI:52490) Incoming cobalt-precorrin-7 (CHEBI:52490) is conjugate acid of cobalt-precorrin-7(7−) (CHEBI:70791) Synonyms Sources Co-precorrin-7 UniProt cobalt-precorrin-7 heptaanion ChEBI Manual Xref Database CPD-9048 MetaCyc View more database links Citations Types Sources 16936030 PubMed citation SUBMITTER 23042036 PubMed citation Europe PMC Last Modified 28 July 2017

General Comment 2013-01-10 The structure depicted is an amendment of a previous tentatively-assigned structure (PMID:16936030) and is based on the first reported isolation and structural elucidation of precorrin-7 described in PMID:23042036. This has been confirmed by personal correspondence with the authors.