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CHEBI:202992 - Scalbucillin A

ChEBI IDCHEBI:202992
ChEBI NameScalbucillin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H14O5
Net Charge0
Average Mass262.261
Monoisotopic Mass262.08412
SMILESC/C=C/C=C/C(=O)c1cc(C(=O)O)c(OC)cc1O
InChIInChI=1S/C14H14O5/c1-3-4-5-6-11(15)9-7-10(14(17)18)13(19-2)8-12(9)16/h3-8,16H,1-2H3,(H,17,18)/b4-3+,6-5+
InChIKeyYUSQNPUACBIUPR-VNKDHWASSA-N
Species of MetaboliteComponentSourceComments
Scytalidium (ncbitaxon:5538) - PubMed (25248727)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Scalbucillin A (CHEBI:202992) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name 
5-[(2E,4E)-hexa-2,4-dienoyl]-4-hydroxy-2-methoxybenzoic acid
Manual XrefsDatabases
78435443ChemSpider