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CHEBI:210718 - 3,4-dihydro-8-hydroxy-6-methoxy-(3R)-propylisocoumarin

Default Structure
ChEBI IDCHEBI:210718
ChEBI Name3,4-dihydro-8-hydroxy-6-methoxy-(3R)-propylisocoumarin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O4
Net Charge0
Average Mass236.267
Monoisotopic Mass236.10486
SMILESCCC[C@@H]1Cc2cc(OC)cc(O)c2C(=O)O1
InChIInChI=1S/C13H16O4/c1-3-4-9-5-8-6-10(16-2)7-11(14)12(8)13(15)17-9/h6-7,9,14H,3-5H2,1-2H3/t9-/m1/s1
InChIKeyRYPQHAKCQSXFGH-SECBINFHSA-N
ChEBI Ontology
Outgoing Relation(s)
3,4-dihydro-8-hydroxy-6-methoxy-(3R)-propylisocoumarin (CHEBI:210718) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3R)-8-hydroxy-6-methoxy-3-propyl-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
24692398ChemSpider