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CHEBI:46448 - ubiquinone-7

ChEBI IDCHEBI:46448
ChEBI Nameubiquinone-7
Stars
DefinitionA compound whose structure comprises a 2,3-dimethoxy-5-methylbenzoquinone nucleus, common to ubiquinones; and a side chain of seven isoprenoid units.
Last Modified31 January 2022
DownloadsMolfile
FormulaC44H66O4
Net Charge0
Average Mass659.008
Monoisotopic Mass658.49611
SMILESCOC1=C(OC)C(=O)C(C/C=C(\C)CC/C=C(\C)CC/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/C44H66O4/c1-32(2)18-12-19-33(3)20-13-21-34(4)22-14-23-35(5)24-15-25-36(6)26-16-27-37(7)28-17-29-38(8)30-31-40-39(9)41(45)43(47-10)44(48-11)42(40)46/h18,20,22,24,26,28,30H,12-17,19,21,23,25,27,29,31H2,1-11H3/b33-20+,34-22+,35-24+,36-26+,37-28+,38-30+
InChIKeyDBESHHFMIFSNRV-RJYQSXAYSA-N
Roles Classification
Biological Roles:
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).
ChEBI Ontology
Outgoing Relation(s)
ubiquinone-7 (CHEBI:46448) is a ubiquinones (CHEBI:16389)
IUPAC Name 
2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
Synonyms  Source
UBIQUINONE-7PDBeChem
2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-5,6-dimethoxy-3-methyl-1,4-benzoquinoneChEBI
ubiquinone 7ChemIDplus
ubiquinone 35ChemIDplus
coenzyme Q7ChemIDplus
ubiquinone Q7ChemIDplus
UniProt Name  Source
ubiquinone-7UniProt
Manual XrefsDatabases
UQ7PDBeChem
Registry NumbersSources
Beilstein:2406878Beilstein
CAS:303-95-7ChemIDplus
Citations