CHEBI:64180 - 2-decaprenyl-6-methoxyhydroquinone

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ChEBI Name 2-decaprenyl-6-methoxyhydroquinone
ChEBI ID CHEBI:64180
Definition A polyprenylhydroquinone in which the polyprenyl substituent is decaprenyl at C-2; a methoxy group is also present at C-6.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Mark Williams
Supplier Information ZINC000004228270
Download Molfile XML SDF
Formula C57H88O3
Net Charge 0
Average Mass 821.30680
Monoisotopic Mass 820.67335
InChI InChI=1S/C57H88O3/c1-44(2)22-13-23-45(3)24-14-25-46(4)26-15-27-47(5)28-16-29-48(6)30-17-31-49(7)32-18-33-50(8)34-19-35-51(9)36-20-37-52(10)38-21-39-53(11)40-41-54-42-55(58)43-56(60-12)57(54)59/h22,24,26,28,30,32,34,36,38,40,42-43,58-59H,13-21,23,25,27,29,31,33,35,37,39,41H2,1-12H3/b45-24+,46-26+,47-28+,48-30+,49-32+,50-34+,51-36+,52-38+,53-40+
InChIKey LIOKNOIJMJKVCG-RDSVHMIISA-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)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)c1O
ChEBI Ontology
Outgoing 2-decaprenyl-6-methoxyhydroquinone (CHEBI:64180) is a 2-methoxy-6-all-trans-polyprenylhydroquinone (CHEBI:84166)
IUPAC Name
2-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-6-methoxybenzene-1,4-diol
Synonyms Sources
2-decaprenyl-6-methoxy-1,4-benzoquinol ChEBI
2-methoxy-6-(all-trans-decaprenyl)benzene-1,4-diol UniProt
2-methoxy-6-decaprenylhydroquinone ChEBI
6-all-trans-decaprenyl-2-methoxy-1,4-benzoquinol SUBMITTER
6-decaprenyl-2-methoxy-1,4-benzoquinol ChEBI
6-decaprenyl-2-methoxyhydroquinone ChEBI
6-methoxy-2-decaprenylhydroquinone ChEBI
Manual Xref Database
CPD-9869 MetaCyc
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Last Modified
25 September 2024