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CHEBI:198776 - (rel)-4beta,8-dihydroxy-3alpha-hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one

ChEBI IDCHEBI:198776
ChEBI Name(rel)-4beta,8-dihydroxy-3alpha-hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O4
Net Charge0
Average Mass222.240
Monoisotopic Mass222.08921
SMILESC[C@@]1(O)c2cccc(O)c2C(=O)C[C@@H]1CO
InChIInChI=1S/C12H14O4/c1-12(16)7(6-13)5-10(15)11-8(12)3-2-4-9(11)14/h2-4,7,13-14,16H,5-6H2,1H3/t7-,12+/m1/s1
InChIKeyXZGKIAFWYRPETG-KRTXAFLBSA-N
Species of MetaboliteComponentSourceComments
Streptomyces rimosus (ncbitaxon:1927) - PubMed (16506700)
ChEBI Ontology
Outgoing Relation(s)
(rel)-4beta,8-dihydroxy-3alpha-hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one (CHEBI:198776) is a tetralins (CHEBI:36786)
IUPAC Name 
(3R,4S)-4,8-dihydroxy-3-(hydroxymethyl)-4-methyl-2,3-dihydronaphthalen-1-one
Manual XrefsDatabases
78439587ChemSpider