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CHEBI:231823 - 3-demethylubiquinone-8(1−)

ChEBI IDCHEBI:231823
ChEBI Name3-demethylubiquinone-8(1−)
Stars
ASCII Name3-demethylubiquinone-8(1-)
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC48H71O4
Net Charge-1
Average Mass712.092
Monoisotopic Mass711.53578
SMILESCOC1=C([O-])C(=O)C(C)=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)CC/C=C(\C)CCC=C(C)C)C1=O
InChIInChI=1S/C48H72O4/c1-35(2)19-12-20-36(3)21-13-22-37(4)23-14-24-38(5)25-15-26-39(6)27-16-28-40(7)29-17-30-41(8)31-18-32-42(9)33-34-44-43(10)45(49)47(51)48(52-11)46(44)50/h19,21,23,25,27,29,31,33,51H,12-18,20,22,24,26,28,30,32,34H2,1-11H3/p-1/b36-21+,37-23+,38-25+,39-27+,40-29+,41-31+,42-33+
InChIKeyJCTZZCUQMAEFJG-WDXILIIOSA-M
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)
3-demethylubiquinone-8(1−) (CHEBI:231823) is a 3-demethylubiquinone(1-) (CHEBI:231825)
3-demethylubiquinone-8(1−) (CHEBI:231823) is a organic molecular entity (CHEBI:50860)
3-demethylubiquinone-8(1−) (CHEBI:231823) is conjugate base of 3-demethylubiquinone-8 (CHEBI:27688)
Incoming Relation(s)
3-demethylubiquinone-8 (CHEBI:27688) is conjugate acid of 3-demethylubiquinone-8(1−) (CHEBI:231823)
UniProt Name  Source
3-demethylubiquinone-8UniProt
Citations