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CHEBI:200448 - Sorbiquinol

ChEBI IDCHEBI:200448
ChEBI NameSorbiquinol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H32O7
Net Charge0
Average Mass480.557
Monoisotopic Mass480.21480
SMILESC/C=C/C=C/C(O)=C1C(=O)[C@@]2(C)C(=O)[C@@](C)(O)[C@H]1[C@H](C(=O)c1cc(C)c(O)c(C)c1O)[C@H]2/C=C/C
InChIInChI=1S/C28H32O7/c1-7-9-10-12-18(29)20-21-19(24(32)16-13-14(3)22(30)15(4)23(16)31)17(11-8-2)27(5,25(20)33)26(34)28(21,6)35/h7-13,17,19,21,29-31,35H,1-6H3/b9-7+,11-8+,12-10+,20-18?/t17-,19-,21+,27+,28+/m1/s1
InChIKeyHKXDEFUWXMTUSX-PIOHOACTSA-N
Species of MetaboliteComponentSourceComments
Trichoderma longibrachiatum (ncbitaxon:5548) - DOI (10.1139/v96-042)
ChEBI Ontology
Outgoing Relation(s)
Sorbiquinol (CHEBI:200448) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(1S,3S,4S,7R,8R)-8-(2,4-dihydroxy-3,5-dimethylbenzoyl)-3-hydroxy-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethyl-7-[(E)-prop-1-enyl]bicyclo[2.2.2]octane-2,6-dione
Manual XrefsDatabases
78440079ChemSpider