CHEBI:181514 - (+)-Dihydrokawain-5-ol

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 (+)-Dihydrokawain-5-ol
ChEBI ID CHEBI:181514
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H16O4
Net Charge 0
Average Mass 248.278
Monoisotopic Mass 248.10486
InChI InChI=1S/C14H16O4/c1-17-12-9-13(15)18-11(14(12)16)8-7-10-5-3-2-4-6-10/h2-6,9,11,14,16H,7-8H2,1H3/t11-,14+/m0/s1
InChIKey VJCNEDVMYQCMBK-SMDDNHRTSA-N
SMILES O1[C@@H](CCC2=CC=CC=C2)[C@@H](O)C(OC)=CC1=O
ChEBI Ontology
Outgoing (+)-Dihydrokawain-5-ol (CHEBI:181514) is a 2-pyranones (CHEBI:75885)
(+)-Dihydrokawain-5-ol (CHEBI:181514) is a aromatic ether (CHEBI:35618)
IUPAC Name
(2S,3R)-3-hydroxy-4-methoxy-2-(2-phenylethyl)-2,3-dihydropyran-6-one
Manual Xref Database
9120003 ChemSpider
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