CHEBI:28956 - cobinamide

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ChEBI Name cobinamide
ChEBI ID CHEBI:28956
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3798, CHEBI:23342
Supplier Information
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Formula C48H72CoN11O8
Net Charge +2
Average Mass 990.08740
InChI InChI=1S/C48H73N11O8.Co/c1-23(60)22-55-38(67)16-17-45(6)29(18-35(52)64)43-48(9)47(8,21-37(54)66)28(12-15-34(51)63)40(59-48)25(3)42-46(7,20-36(53)65)26(10-13-32(49)61)30(56-42)19-31-44(4,5)27(11-14-33(50)62)39(57-31)24(2)41(45)58-43;/h19,23,26-29,43,60H,10-18,20-22H2,1-9H3,(H14,49,50,51,52,53,54,55,56,57,58,59,61,62,63,64,65,66,67);/q;+3/p-1/t23-,26-,27-,28-,29+,43-,45-,46+,47+,48+;/m1./s1
InChIKey FEESAGIUMZGLMF-JFYQDRLCSA-M
SMILES [H][C@@]12[C@H](CC(N)=O)[C@@](C)(CCC(=O)NC[C@@H](C)O)C3=C(C)C4=[N]5C(=CC6=[N]7C(=C(C)C8=[N]([C@]1(C)[C@@](C)(CC(N)=O)[C@@H]8CCC(N)=O)[Co++]57N23)[C@@](C)(CC(N)=O)[C@@H]6CCC(N)=O)C(C)(C)[C@@H]4CCC(N)=O
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:562) See: PubMed
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cobinamide (CHEBI:28956) has role Escherichia coli metabolite (CHEBI:76971)
cobinamide (CHEBI:28956) has role mouse metabolite (CHEBI:75771)
cobinamide (CHEBI:28956) is a cobalt-corrinoid hexaamide (CHEBI:23390)
Incoming adenosylcobinamide (CHEBI:2480) has functional parent cobinamide (CHEBI:28956)
adenosylcobinamide phosphate (CHEBI:2481) has functional parent cobinamide (CHEBI:28956)
Synonyms Sources
Cbi CBN
Cob(I)inamide KEGG COMPOUND
Cobinamid ChEBI
Cobinamide KEGG COMPOUND
cobinamide CBN
Database Links Databases
C05774 KEGG COMPOUND
CBY PDBeChem
View more database links
Registry Numbers Types Sources
1018261 Gmelin Registry Number Gmelin
13497-85-3 CAS Registry Number ChemIDplus
4122727 Beilstein Registry Number Beilstein
Last Modified
27 janvier 2016