CHEBI:28911 - cob(III)alamin

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ChEBI Name cob(III)alamin
ChEBI ID CHEBI:28911
ChEBI ASCII Name cob(III)alamin
Definition A cobalamin in which the central cobalt atom has an oxidation state of +3.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:23332, CHEBI:10006
Supplier Information
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Formula C62H88CoN13O14P
Net Charge +1
Average Mass 1329.34780
Monoisotopic Mass 1328.564
InChI InChI=1S/C62H90N13O14P.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H15,63,64,65,66,67,68,69,71,72,73,74,77,78,79,80,81,82,83,85,86);/q;+3/p-2/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;/m1./s1
InChIKey NSLAUEAQDBERRV-DSRCUDDDSA-L
SMILES [H][C@]12[C@H](CC(N)=O)[C@@]3(C)CCC(=O)NC[C@@H](C)OP([O-])(=O)O[C@H]4[C@@H](O)[C@H](O[C@@H]4CO)n4c[n+](c5cc(C)c(C)cc45)[Co--]456N1C3=C(C)C1=[N+]4C(=CC3=[N+]5C(=C(C)C4=[N+]6[C@]2(C)[C@@](C)(CC(N)=O)[C@@H]4CCC(N)=O)[C@@](C)(CC(N)=O)[C@@H]3CCC(N)=O)C(C)(C)[C@@H]1CCC(N)=O
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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).
(via cobalamin )
prosthetic group
A tightly bound, specific nonpolypeptide unit in a protein determining and involved in its biological activity.
(via cobalamin )
B vitamin
Any of the group of eight water-soluble vitamins originally thought to be a single compound (vitamin B) that play important roles in cell metabolism. The group comprises vitamin B1, B2, B3, B5, B6, B7, B9, and B12. (Around 20 other compounds were once thought to be B vitamins but are no longer classified as such.)
(via cobalamin )
Application(s): B vitamin
Any of the group of eight water-soluble vitamins originally thought to be a single compound (vitamin B) that play important roles in cell metabolism. The group comprises vitamin B1, B2, B3, B5, B6, B7, B9, and B12. (Around 20 other compounds were once thought to be B vitamins but are no longer classified as such.)
(via cobalamin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cob(III)alamin (CHEBI:28911) has role mouse metabolite (CHEBI:75771)
cob(III)alamin (CHEBI:28911) is a cobalamin (CHEBI:30411)
IUPAC Name
cob(III)alamin
Synonyms Sources
α-(5,6-dimethylbenzimidazolyl)cobamide CBN
Cbl CBN
cob(III)alamin UniProt
Cob(III)alamin KEGG COMPOUND
Cobalamin (III) KEGG COMPOUND
cobalamin(1+) ChemIDplus
cobalamin(III) ChEBI
Database Links Databases
C05776 KEGG COMPOUND
D00191 KEGG DRUG
MOL000035 COMe
View more database links
Registry Numbers Types Sources
13408-78-1 CAS Registry Number ChemIDplus
2291945 Gmelin Registry Number Gmelin
Last Modified
27 January 2016