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CHEBI:207184 - Gliomastin A

ChEBI IDCHEBI:207184
ChEBI NameGliomastin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H22O4
Net Charge0
Average Mass350.414
Monoisotopic Mass350.15181
SMILESC=C(C)[C@H]1C[C@]23CC(C)=C[C@@H](c4cc(O)ccc4O)[C@]12C(=O)C=CC3=O
InChIInChI=1S/C22H22O4/c1-12(2)17-11-21-10-13(3)8-16(15-9-14(23)4-5-18(15)24)22(17,21)20(26)7-6-19(21)25/h4-9,16-17,23-24H,1,10-11H2,2-3H3/t16-,17+,21-,22+/m0/s1
InChIKeyZJTLBAAQNINYML-DEVSCXNHSA-N
Species of MetaboliteComponentSourceComments
Gliomastixspecies (ncbitaxon:2012032) - DOI (10.1039/c7ra04941b)
ChEBI Ontology
Outgoing Relation(s)
Gliomastin A (CHEBI:207184) is a hydroquinones (CHEBI:24646)
IUPAC Name 
(1S,6R,7S,12R)-7-(2,5-dihydroxyphenyl)-9-methyl-12-prop-1-en-2-yltricyclo[4.4.2.01,6]dodeca-3,8-diene-2,5-dione
Manual XrefsDatabases
59718401ChemSpider