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CHEBI:132627 - (+)-angenomalin

ChEBI IDCHEBI:132627
ChEBI Name(+)-angenomalin
Stars
DefinitionA furanocoumarin that is 8,9-dihydro-2H-furo[2,3-h][1]benzopyran-2-one carrying a prop-1-en-2-yl substituent at position 8.
Last Modified24 November 2016
Submitterliuqingping
DownloadsMolfile
FormulaC14H12O3
Net Charge0
Average Mass228.247
Monoisotopic Mass228.07864
SMILESC=C(C)[C@@H]1Cc2c(ccc3ccc(=O)oc23)O1
InChIInChI=1S/C14H12O3/c1-8(2)12-7-10-11(16-12)5-3-9-4-6-13(15)17-14(9)10/h3-6,12H,1,7H2,2H3/t12-/m0/s1
InChIKeyWLRXMMDATRQQNQ-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Notopterygium incisum (ncbitaxon:54724)
root (BTO:0001188) PubMed (20707067)
rhizome (BTO:0001181) PubMed (20707067)
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)
(+)-angenomalin (CHEBI:132627) has role plant metabolite (CHEBI:76924)
(+)-angenomalin (CHEBI:132627) is a furanocoumarin (CHEBI:24128)
(+)-angenomalin (CHEBI:132627) is a olefinic compound (CHEBI:78840)
IUPAC Name 
(8S)-8-(prop-1-en-2-yl)-8,9-dihydro-2H-furo[2,3-h][1]benzopyran-2-one
Synonyms  Source
angenomalinChEBI
(S)-angenomalinChEBI
Registry NumbersSources
Reaxys:9561305Reaxys
Citations