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CHEBI:52488 - cobalt-precorrin-5A

ChEBI IDCHEBI:52488
ChEBI Namecobalt-precorrin-5A
Stars
Last Modified24 October 2012
SubmitterSteve
DownloadsMolfile
FormulaC45H52CoN4O16
Net Charge0
Average Mass963.856
Monoisotopic Mass963.27103
SMILESCC1OC(=O)C[C@@]2(C)[C@H](CCC(=O)O)C3=CC4=[N+]5C(=C(CCC(=O)O)[C@]4(C)CC(=O)O)C[C@@]4(C)C(CC(=O)O)=C(CCC(=O)O)C6=CC7=[N+]8C(=C(CC(=O)O)[C@@]7(C)CCC(=O)O)C12[N]3[Co-2]58[N]64
InChIInChI=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-2/t21?,24-,41-,42+,43+,44+,45?;/m1./s1
InChIKeyFMPRUTAGAUSVOA-IBAGIMPYSA-L
Roles Classification
Biological Role:
cofactor  An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
ChEBI Ontology
Outgoing Relation(s)
cobalt-precorrin-5A (CHEBI:52488) is a cobalt corrinoid (CHEBI:33906)
cobalt-precorrin-5A (CHEBI:52488) is conjugate acid of cobalt-precorrin-5A(7−) (CHEBI:60062)
Incoming Relation(s)
cobalt-precorrin-5A(7−) (CHEBI:60062) is conjugate base of cobalt-precorrin-5A (CHEBI:52488)
Synonym  Source
Cobalt-precorrin 5AKEGG COMPOUND
Manual XrefsDatabases
C16242KEGG COMPOUND
Citations