CHEBI:157734 - Tetrahydro-11-methoxyiangonin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Tetrahydro-11-methoxyiangonin
ChEBI ID CHEBI:157734
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H20O5
Net Charge 0
Average Mass 292.331
Monoisotopic Mass 292.13107
InChI InChI=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
InChIKey HEURTYMJWQPWNN-LBPRGKRZSA-N
SMILES O1[C@@H](CCC2=CC(OC)=C(OC)C=C2)CC(OC)=CC1=O
Metabolite of Species Details
Piper methysticum (NCBI:txid130404) Found in stem (BTO:0001300). of strain Piper methysticum cv. Loa Kasa Leka See: MetaboLights Study
Piper methysticum (NCBI:txid130404) Found in lateral root (BTO:0005441). of strain Piper methysticum cv. Loa Kasa Leka See: MetaboLights Study
Piper methysticum (NCBI:txid130404) Found in crown root (PO:0000043). of strain Piper methysticum cv. Loa Kasa Leka See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
20047847 ChemSpider
View more database links