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CHEBI:169688 - (+/-)-Anisoxide

ChEBI IDCHEBI:169688
ChEBI Name(+/-)-Anisoxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O
Net Charge0
Average Mass202.297
Monoisotopic Mass202.13577
SMILESC/C=C\c1ccc2c(c1)C(C)C(C)(C)O2
InChIInChI=1S/C14H18O/c1-5-6-11-7-8-13-12(9-11)10(2)14(3,4)15-13/h5-10H,1-4H3/b6-5-
InChIKeyYXEPEHFXXORWGP-WAYWQWQTSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
(+/-)-Anisoxide (CHEBI:169688) is a 1-benzofurans (CHEBI:38830)
IUPAC Name 
2,2,3-trimethyl-5-[(Z)-prop-1-enyl]-3H-1-benzouran
Manual XrefsDatabases
35013227ChemSpider
HMDB0030572HMDB