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CHEBI:46331 - ubiquinone-5

ChEBI IDCHEBI:46331
ChEBI Nameubiquinone-5
Stars
DefinitionA compound composed of the 2,3-dimethoxy-5-methylbenzoquinone nucleus common to ubiquinones; and a side chain of five isoprenoid units.
Secondary ChEBI IDsCHEBI:27183, CHEBI:46329
Last Modified31 January 2022
DownloadsMolfile
FormulaC34H50O4
Net Charge0
Average Mass522.770
Monoisotopic Mass522.37091
SMILESCOC1=C(OC)C(=O)C(C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)=C(C)C1=O
InChIInChI=1S/C34H50O4/c1-24(2)14-10-15-25(3)16-11-17-26(4)18-12-19-27(5)20-13-21-28(6)22-23-30-29(7)31(35)33(37-8)34(38-9)32(30)36/h14,16,18,20,22H,10-13,15,17,19,21,23H2,1-9H3/b25-16+,26-18+,27-20+,28-22+
InChIKeyNYFAQDMDAFCWPU-UVCHAVPFSA-N
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
ubiquinone-5 (CHEBI:46331) is a ubiquinones (CHEBI:16389)
IUPAC Name 
2,3-dimethoxy-5-methyl-6-[(2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-yl]cyclohexa-2,5-diene-1,4-dione
Synonyms  Source
ubiquinone 5ChemIDplus
(all-E)-2,3-dimethoxy-5-methyl-6-(3,7,11,15,19-pentamethyl-2,6,10,14,18-eicosapentaenyl)-2,5-cyclohexadiene-1,4-dioneChemIDplus
2,3-DIMETHOXY-5-METHYL-6-(3,11,15,19-TETRAMETHYL-EICOSA-2,6,10,14,18-PENTAENYL)-[1,4]BENZOQUINONEPDBeChem
2,3-dimethoxy-5-methyl-6-[(2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-yl]-1,4-benzoquinoneChEBI
coenzyme Q5ChEBI
CoQ5ChEBI
UniProt Name  Source
ubiquinone-5UniProt
Manual XrefsDatabases
UQ5PDBeChem
Registry NumbersSources
Beilstein:2315703Beilstein
CAS:4370-61-0ChemIDplus
Citations