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CHEBI:84431 - 3-demethylubiquinol-7

ChEBI IDCHEBI:84431
ChEBI Name3-demethylubiquinol-7
Stars
DefinitionA 3-demethylubiquinol in which the polyprenyl chain contains 7 prenyl units.
Last Modified8 March 2017
SubmitterAnne Morgat
DownloadsMolfile
FormulaC43H66O4
Net Charge0
Average Mass646.997
Monoisotopic Mass646.49611
SMILESCOc1c(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)CCC=C(C)C)c1O
InChIInChI=1S/C43H66O4/c1-31(2)17-11-18-32(3)19-12-20-33(4)21-13-22-34(5)23-14-24-35(6)25-15-26-36(7)27-16-28-37(8)29-30-39-38(9)40(44)42(46)43(47-10)41(39)45/h17,19,21,23,25,27,29,44-46H,11-16,18,20,22,24,26,28,30H2,1-10H3/b32-19+,33-21+,34-23+,35-25+,36-27+,37-29+
InChIKeyOHBHBMXNJCUMCR-DKCCAHEHSA-N
ChEBI Ontology
Outgoing Relation(s)
3-demethylubiquinol-7 (CHEBI:84431) is a 3-demethylubiquinol (CHEBI:84422)
3-demethylubiquinol-7 (CHEBI:84431) is a hydroquinones (CHEBI:24646)
IUPAC Name 
5-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-3-methoxy-6-methylbenzene-1,2,4-triol
Synonym  Source
2-heptaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinolMetaCyc
UniProt Name  Source
3-demethylubiquinol-7UniProt
Manual XrefsDatabases
CPD-9861MetaCyc