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CHEBI:84531 - 2-methoxy-3-methyl-6-all-trans-nonaprenylhydroquinone

ChEBI IDCHEBI:84531
ChEBI Name2-methoxy-3-methyl-6-all-trans-nonaprenylhydroquinone
Stars
ASCII Name2-methoxy-3-methyl-6-all-trans-nonaprenylhydroquinone
DefinitionA 6-methoxy-3-methyl-2-all-trans-polyprenylhydroquinone in which the polyprenyl component is specified as all-trans-nonaprenyl.
Last Modified25 September 2024
SubmitterAnne Morgat
DownloadsMolfile
FormulaC53H82O3
Net Charge0
Average Mass767.236
Monoisotopic Mass766.62640
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)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)c1O
InChIInChI=1S/C53H82O3/c1-40(2)21-13-22-41(3)23-14-24-42(4)25-15-26-43(5)27-16-28-44(6)29-17-30-45(7)31-18-32-46(8)33-19-34-47(9)35-20-36-48(10)37-38-50-49(11)51(54)39-52(56-12)53(50)55/h21,23,25,27,29,31,33,35,37,39,54-55H,13-20,22,24,26,28,30,32,34,36,38H2,1-12H3/b41-23+,42-25+,43-27+,44-29+,45-31+,46-33+,47-35+,48-37+
InChIKeyGLNRSJSLTUCXTP-IQSNHBBHSA-N
ChEBI Ontology
Outgoing Relation(s)
2-methoxy-3-methyl-6-all-trans-nonaprenylhydroquinone (CHEBI:84531) is a 2-methoxy-5-methyl-6-all-trans-polyprenylhydroquinone (CHEBI:84167)
2-methoxy-3-methyl-6-all-trans-nonaprenylhydroquinone (CHEBI:84531) is a hydroquinones (CHEBI:24646)
IUPAC Name 
5-methoxy-2-methyl-3-[(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-nonaen-1-yl]benzene-1,4-diol
Synonyms  Source
6-methoxy-3-methyl-2-all-trans-nonaprenylhydroquinoneChEBI
2-methoxy-3-methyl-6-all-trans-nonaprenyl-1,4-benzoquinolChEBI
2-nonaprenyl-3-methyl-6-methoxy-1,4-benzoquinolMetaCyc
6-methoxy-3-methyl-2-nonaprenyl-1,4-benzoquinolMetaCyc
UniProt Name  Source
5-methoxy-2-methyl-3-(all-trans-nonaprenyl)benzene-1,4-diolUniProt
Manual XrefsDatabases
CPD-9872MetaCyc