CHEBI:1235 - 2-methoxy-6-(all-trans-octaprenyl)phenol

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ChEBI Name 2-methoxy-6-(all-trans-octaprenyl)phenol
ChEBI ID CHEBI:1235
ChEBI ASCII Name 2-methoxy-6-(all-trans-octaprenyl)phenol
Definition A 2-methoxy-6-(all-trans-polyprenyl)phenol in which the substituent at position 6 is an all-trans-octaprenyl moiety.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formulae C47H72O2
C47H72O2
Net Charge 0
Average Mass 669.075
Monoisotopic Mass 668.553
InChI InChI=1S/C47H72O2/c1-37(2)19-11-20-38(3)21-12-22-39(4)23-13-24-40(5)25-14-26-41(6)27-15-28-42(7)29-16-30-43(8)31-17-32-44(9)35-36-45-33-18-34-46(49-10)47(45)48/h18-19,21,23,25,27,29,31,33-35,48H,11-17,20,22,24,26,28,30,32,36H2,1-10H3/b38-21+,39-23+,40-25+,41-27+,42-29+,43-31+,44-35+
InChIKey MARGKPIMNMASKJ-CMAXTTDKSA-N
SMILES OC1=C(C\C=C(\CC\C=C(\CC\C=C(\CC\C=C(\CC\C=C(\CC\C=C(\CC\C=C(\CCC=C(C)C)/C)/C)/C)/C)/C)/C)/C)C=CC=C1OC
Metabolite of Species Details
Escherichia coli (NCBI:txid562) See: PubMed
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-methoxy-6-(all-trans-octaprenyl)phenol (CHEBI:1235) has role Escherichia coli metabolite (CHEBI:76971)
2-methoxy-6-(all-trans-octaprenyl)phenol (CHEBI:1235) is a 2-methoxy-6-(all-trans-polyprenyl)phenol (CHEBI:62731)
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]phenol
Synonyms Sources
2-methoxy-6-(all-trans-octaprenyl)phenol UniProt
2-Octaprenyl-6-methoxyphenol KEGG COMPOUND
6-methoxy-2-octaprenylphenol ChEBI
Manual Xrefs Databases
2-OCTAPRENYL-6-METHOXYPHENOL MetaCyc
C05812 KEGG COMPOUND
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Citations Waiting for Citations Types Sources
10419476 PubMed citation Europe PMC
8703953 PubMed citation Europe PMC
Last Modified
08 October 2018