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CHEBI:28813 - sinapyl alcohol

ChEBI IDCHEBI:28813
ChEBI Namesinapyl alcohol
Stars
DefinitionA primary alcohol, being cinnamyl alcohol hydroxylated at C-4 and methoxylated at C-3 and -5.
Secondary ChEBI IDsCHEBI:9158, CHEBI:26683
Last Modified6 July 2016
DownloadsMolfile
FormulaC11H14O4
Net Charge0
Average Mass210.229
Monoisotopic Mass210.08921
SMILESCOc1cc(C=CCO)cc(OC)c1O
InChIInChI=1S/C11H14O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-4,6-7,12-13H,5H2,1-2H3
InChIKeyLZFOPEXOUVTGJS-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)
sinapyl alcohol (CHEBI:28813) has functional parent cinnamyl alcohol (CHEBI:17177)
sinapyl alcohol (CHEBI:28813) has role plant metabolite (CHEBI:76924)
sinapyl alcohol (CHEBI:28813) is a dimethoxybenzene (CHEBI:51681)
sinapyl alcohol (CHEBI:28813) is a phenols (CHEBI:33853)
sinapyl alcohol (CHEBI:28813) is a primary alcohol (CHEBI:15734)
Incoming Relation(s)
simulanol (CHEBI:86940) has functional parent sinapyl alcohol (CHEBI:28813)
trans-sinapyl alcohol (CHEBI:64557) is a sinapyl alcohol (CHEBI:28813)
IUPAC Name 
4-(3-hydroxyprop-1-en-1-yl)-2,6-dimethoxyphenol
Synonyms  Source
Sinapic alcoholChemIDplus
Sinapoyl alcoholKEGG COMPOUND
Sinapyl alcoholKEGG COMPOUND
Manual XrefsDatabases
C02325KEGG COMPOUND
Registry NumbersSources
Reaxys:3084125Reaxys
CAS:537-33-7ChemIDplus
CAS:537-33-7KEGG COMPOUND
Citations