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CHEBI:212709 - (3R*,4S*)-3,4,8-trihydroxy-6,7-dimethyl-3,4-dihydro-1(2H)-naphthalenone

ChEBI IDCHEBI:212709
ChEBI Name(3R*,4S*)-3,4,8-trihydroxy-6,7-dimethyl-3,4-dihydro-1(2H)-naphthalenone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O4
Net Charge0
Average Mass222.240
Monoisotopic Mass222.08921
SMILESCc1cc2c(c(O)c1C)C(=O)C[C@@H](O)[C@H]2O
InChIInChI=1S/C12H14O4/c1-5-3-7-10(11(15)6(5)2)8(13)4-9(14)12(7)16/h3,9,12,14-16H,4H2,1-2H3/t9-,12+/m1/s1
InChIKeyVRGDKEJODCLSBA-SKDRFNHKSA-N
Species of MetaboliteComponentSourceComments
Nodulisporiumspecies (ncbitaxon:1897413) - DOI (10.1016/j.phytol.2015.08.001)
ChEBI Ontology
Outgoing Relation(s)
(3R*,4S*)-3,4,8-trihydroxy-6,7-dimethyl-3,4-dihydro-1(2H)-naphthalenone (CHEBI:212709) is a tetralins (CHEBI:36786)
IUPAC Name 
(3R,4S)-3,4,8-trihydroxy-6,7-dimethyl-3,4-dihydro-2H-naphthalen-1-one
Manual XrefsDatabases
78442115ChemSpider