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CHEBI:199547 - (+)-applanatumol O

Default Structure
ChEBI IDCHEBI:199547
ChEBI Name(+)-applanatumol O
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O6
Net Charge0
Average Mass304.298
Monoisotopic Mass304.09469
SMILESO=CC1=CCC[C@@](CC(=O)c2cc(O)ccc2O)(C(=O)O)C1
InChIInChI=1S/C16H16O6/c17-9-10-2-1-5-16(7-10,15(21)22)8-14(20)12-6-11(18)3-4-13(12)19/h2-4,6,9,18-19H,1,5,7-8H2,(H,21,22)/t16-/m1/s1
InChIKeyBIAWVSQLGIZZHL-MRXNPFEDSA-N
Species of MetaboliteComponentSourceComments
Ganoderma applanatum (ncbitaxon:29884) - DOI (10.1016/j.tet.2016.06.019)
ChEBI Ontology
Outgoing Relation(s)
(+)-applanatumol O (CHEBI:199547) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(1R)-1-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-3-ormylcyclohex-3-ene-1-carboxylic acid
Manual XrefsDatabases
78440777ChemSpider