CHEBI:60655 - 6-methoxy-2-octaprenylhydroquinone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-methoxy-2-octaprenylhydroquinone
ChEBI ID CHEBI:60655
Definition A polyprenylhydroquinone in which the polyprenyl substituent is octaprenyl at C-2; a methoxy group is also present at C-6.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Eugeni Belda
Supplier Information
Download Molfile XML SDF
Formula C47H72O3
Net Charge 0
Average Mass 685.07280
Monoisotopic Mass 684.548
InChI InChI=1S/C47H72O3/c1-36(2)18-11-19-37(3)20-12-21-38(4)22-13-23-39(5)24-14-25-40(6)26-15-27-41(7)28-16-29-42(8)30-17-31-43(9)32-33-44-34-45(48)35-46(50-10)47(44)49/h18,20,22,24,26,28,30,32,34-35,48-49H,11-17,19,21,23,25,27,29,31,33H2,1-10H3/b37-20+,38-22+,39-24+,40-26+,41-28+,42-30+,43-32+
InChIKey CZFRMASEEPTBAQ-MYCGWMCTSA-N
SMILES COc1cc(O)cc(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)c1O
ChEBI Ontology
Outgoing 6-methoxy-2-octaprenylhydroquinone (CHEBI:60655) is a hydroquinones (CHEBI:24646)
6-methoxy-2-octaprenylhydroquinone (CHEBI:60655) is a polyprenylhydroquinone (CHEBI:26253)
IUPAC Name
2-methoxy-6-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]benzene-1,4-diol
Synonyms Sources
2-methoxy-6-all-trans-octaprenyl-1,4-benzoquinol UniProt
2-octaprenyl-6-methoxy-1,4-benzoquinol ChEBI
6-methoxy-2-octaprenylquinol ChEBI
Database Link Database
OCTAPRENYL-METHOXY-BENZOQUINONE MetaCyc
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Last Modified
27 January 2015