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CHEBI:16151 - 3,4-dihydrocoumarin

ChEBI IDCHEBI:16151
ChEBI Name3,4-dihydrocoumarin
Stars
DefinitionA chromanone that is the 3,4-dihydro derivative of coumarin.
Secondary ChEBI IDsCHEBI:4560, CHEBI:14147, CHEBI:23737
Last Modified13 November 2017
DownloadsMolfile
FormulaC9H8O2
Net Charge0
Average Mass148.161
Monoisotopic Mass148.05243
SMILESO=C1CCc2ccccc2O1
InChIInChI=1S/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H2
InChIKeyVMUXSMXIQBNMGZ-UHFFFAOYSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
3,4-dihydrocoumarin (CHEBI:16151) has functional parent coumarin (CHEBI:28794)
3,4-dihydrocoumarin (CHEBI:16151) has role plant metabolite (CHEBI:76924)
3,4-dihydrocoumarin (CHEBI:16151) is a chromanone (CHEBI:38763)
IUPAC Name 
3,4-dihydro-2H-1-benzopyran-2-one
Synonyms  Source
DihydrocoumarinKEGG COMPOUND
3,4-DihydrocoumarinKEGG COMPOUND
3,4-dihydrocoumarinChEBI
1,2-benzodihydropyroneChemIDplus
2-chromanoneChemIDplus
2-hydroxydihydrocinnamic acid lactoneChemIDplus
UniProt Name  Source
3,4-dihydrocoumarinUniProt
Manual XrefsDatabases
C02274KEGG COMPOUND
c0397UM-BBD
DIHYDROCOUMARINMetaCyc
HMDB0036626HMDB
Registry NumbersSources
Gmelin:874678Gmelin
Reaxys:4584Reaxys
CAS:119-84-6KEGG COMPOUND
CAS:119-84-6ChemIDplus
CAS:119-84-6NIST Chemistry WebBook
Citations