EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:220379 - (+)-applanatumol Q

ChEBI IDCHEBI:220379
ChEBI Name(+)-applanatumol Q
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22O7
Net Charge0
Average Mass338.356
Monoisotopic Mass338.13655
SMILESCOC(=O)[C@@]1(CC(=O)c2cc(O)ccc2O)CC[C@@H](C(C)CO)O1
InChIInChI=1S/C17H22O7/c1-10(9-18)15-5-6-17(24-15,16(22)23-2)8-14(21)12-7-11(19)3-4-13(12)20/h3-4,7,10,15,18-20H,5-6,8-9H2,1-2H3/t10?,15-,17-/m0/s1
InChIKeyLSZVUGCMASOQBS-MEGFBMHJSA-N
Species of MetaboliteComponentSourceComments
Ganoderma applanatum (ncbitaxon:29884) - DOI (10.1016/j.tet.2016.06.019)
ChEBI Ontology
Outgoing Relation(s)
(+)-applanatumol Q (CHEBI:220379) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
methyl (2S,5S)-2-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-5-(1-hydroxypropan-2-yl)oxolane-2-carboxylate
Manual XrefsDatabases
78441384ChemSpider