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CHEBI:1458 - (Z)-3-butylidene-7-hydroxyphthalide

ChEBI IDCHEBI:1458
ChEBI Name(Z)-3-butylidene-7-hydroxyphthalide
Stars
ASCII Name(Z)-3-butylidene-7-hydroxyphthalide
DefinitionA 2-benzofuran consisting of phthalide having a butylidene group at the 3-position.
Last Modified28 July 2014
DownloadsMolfile
FormulaC12H12O3
Net Charge0
Average Mass204.225
Monoisotopic Mass204.07864
SMILESCCC/C=C1\OC(=O)c2c(O)cccc21
InChIInChI=1S/C12H12O3/c1-2-3-7-10-8-5-4-6-9(13)11(8)12(14)15-10/h4-7,13H,2-3H2,1H3/b10-7-
InChIKeyXLFDJKJEYMKLJX-YFHOEESVSA-N
ChEBI Ontology
Outgoing Relation(s)
(Z)-3-butylidene-7-hydroxyphthalide (CHEBI:1458) has functional parent 2-benzofuran-1(3H)-one (CHEBI:38085)
(Z)-3-butylidene-7-hydroxyphthalide (CHEBI:1458) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
(3Z)-3-butylidene-7-hydroxy-2-benzofuran-1(3H)-one
Synonyms  Source
3-Butylidene-7-hydroxyphthalideKEGG COMPOUND
(3Z)-3-butylidene-7-hydroxyisobenzofuran-1(3H)-oneChEBI
7-hydroxy-3-butylidenephthalideChEBI
senkyunolide BChEBI
Manual XrefsDatabases
C09921KEGG COMPOUND
KR20050023998Patent
C00002983KNApSAcK
Registry NumbersSources
Reaxys:3544588Reaxys
CAS:93236-67-0KEGG COMPOUND