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CHEBI:157734 - Tetrahydro-11-methoxyiangonin

ChEBI IDCHEBI:157734
ChEBI NameTetrahydro-11-methoxyiangonin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O5
Net Charge0
Average Mass292.331
Monoisotopic Mass292.13107
SMILESCOC1=CC(=O)O[C@@H](CCc2ccc(OC)c(OC)c2)C1
InChIInChI=1S/C16H20O5/c1-18-13-9-12(21-16(17)10-13)6-4-11-5-7-14(19-2)15(8-11)20-3/h5,7-8,10,12H,4,6,9H2,1-3H3/t12-/m0/s1
InChIKeyHEURTYMJWQPWNN-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Piper methysticum (ncbitaxon:130404)
stem (BTO:0001300) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
crown root (PO:0000043) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
lateral root (BTO:0005441) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
ChEBI Ontology
Outgoing Relation(s)
Tetrahydro-11-methoxyiangonin (CHEBI:157734) is a 2-pyranones (CHEBI:75885)
Tetrahydro-11-methoxyiangonin (CHEBI:157734) is a aromatic ether (CHEBI:35618)
IUPAC Name 
(2S)-2-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-2,3-dihydropyran-6-one
Manual XrefsDatabases
20047847ChemSpider