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CHEBI:84530 - 6-methoxy-3-methyl-2-all-trans-heptaprenylhydroquinone

ChEBI IDCHEBI:84530
ChEBI Name6-methoxy-3-methyl-2-all-trans-heptaprenylhydroquinone
Stars
ASCII Name6-methoxy-3-methyl-2-all-trans-heptaprenylhydroquinone
DefinitionA 6-methoxy-3-methyl-2-all-trans-polyprenylhydroquinone in which the polyprenyl component is specified as all-trans-heptaprenyl.
Last Modified25 September 2024
SubmitterAnne Morgat
DownloadsMolfile
FormulaC43H66O3
Net Charge0
Average Mass630.998
Monoisotopic Mass630.50120
SMILESCOc1cc(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/C43H66O3/c1-32(2)17-11-18-33(3)19-12-20-34(4)21-13-22-35(5)23-14-24-36(6)25-15-26-37(7)27-16-28-38(8)29-30-40-39(9)41(44)31-42(46-10)43(40)45/h17,19,21,23,25,27,29,31,44-45H,11-16,18,20,22,24,26,28,30H2,1-10H3/b33-19+,34-21+,35-23+,36-25+,37-27+,38-29+
InChIKeyROHKDMWQXDHLDY-HOHOQCMASA-N
ChEBI Ontology
Outgoing Relation(s)
6-methoxy-3-methyl-2-all-trans-heptaprenylhydroquinone (CHEBI:84530) is a 2-methoxy-5-methyl-6-all-trans-polyprenylhydroquinone (CHEBI:84167)
6-methoxy-3-methyl-2-all-trans-heptaprenylhydroquinone (CHEBI:84530) is a hydroquinones (CHEBI:24646)
IUPAC Name 
3-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-5-methoxy-2-methylbenzene-1,4-diol
Synonyms  Source
2-methoxy-3-methyl-6-all-trans-heptaprenylhydroquinoneChEBI
2-methoxy-3-methyl-6-all-trans-heptaprenyl-1,4-benzoquinolChEBI
6-methoxy-3-methyl-2-heptaprenyl-1,4-benzoquinolMetaCyc
UniProt Name  Source
5-methoxy-2-methyl-3-(all-trans-heptaprenyl)benzene-1,4-diolUniProt
Manual XrefsDatabases
CPD-9859MetaCyc