CHEBI:16304 - cob(II)alamin

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ChEBI Name cob(II)alamin
ChEBI ID CHEBI:16304
ChEBI ASCII Name cob(II)alamin
Definition A cobalamin in which the central cobalt atom has an oxidation state of +2.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3786, CHEBI:14005, CHEBI:23330
Supplier Information
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Formula C62H88CoN13O14P
Net Charge 0
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;+2/p-2/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;/m1./s1
InChIKey ASARMUCNOOHMLO-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-3]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
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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(II)alamin (CHEBI:16304) has role human metabolite (CHEBI:77746)
cob(II)alamin (CHEBI:16304) is a cobalamin (CHEBI:30411)
IUPAC Name
cob(II)alamin
Synonyms Sources
cob(II)alamin UniProt
Cob(II)alamin KEGG COMPOUND
vitamin B-12r CBN
Vitamin B12r KEGG COMPOUND
Database Links Databases
C00541 KEGG COMPOUND
MOL000033 COMe
View more database links
Registry Numbers Types Sources
1243558 Gmelin Registry Number Gmelin
14463-33-3 CAS Registry Number KEGG COMPOUND
14463-33-3 CAS Registry Number ChemIDplus
Last Modified
04 August 2014