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CHEBI:203861 - 2-nonaprenyl-6-methoxy-1,4-benzoquinone

ChEBI IDCHEBI:203861
ChEBI Name2-nonaprenyl-6-methoxy-1,4-benzoquinone
Stars
Last Modified16 August 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC52H78O3
Net Charge0
Average Mass751.193
Monoisotopic Mass750.59510
SMILESCOC1=CC(=O)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)CC/C=C(\C)CCC=C(C)C)C1=O
InChIInChI=1S/C52H78O3/c1-40(2)20-12-21-41(3)22-13-23-42(4)24-14-25-43(5)26-15-27-44(6)28-16-29-45(7)30-17-31-46(8)32-18-33-47(9)34-19-35-48(10)36-37-49-38-50(53)39-51(55-11)52(49)54/h20,22,24,26,28,30,32,34,36,38-39H,12-19,21,23,25,27,29,31,33,35,37H2,1-11H3/b41-22+,42-24+,43-26+,44-28+,45-30+,46-32+,47-34+,48-36+
InChIKeyDSQJYJRTAYOLRM-JSGWLJPKSA-N
Species of MetaboliteComponentSourceComments
Rhodospirillum rubrum (ncbitaxon:1085) - PubMed (5797102)
ChEBI Ontology
Outgoing Relation(s)
2-nonaprenyl-6-methoxy-1,4-benzoquinone (CHEBI:203861) is a 2-methoxy-6-all-trans-polyprenyl-1,4-benzoquinone (CHEBI:231819)
IUPAC Name 
2-methoxy-6-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl]cyclohexa-2,5-diene-1,4-dione
UniProt Name  Source
2-methoxy-6-all-trans-nonaprenyl-1,4-benzoquinoneUniProt
Manual XrefsDatabases
58838099ChemSpider