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> Main
CHEBI:28813 - sinapyl alcohol
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ChEBI Name
sinapyl alcohol
ChEBI ID
CHEBI:28813
Definition
A primary alcohol, being cinnamyl alcohol hydroxylated at C-4 and methoxylated at C-3 and -5.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:26683, CHEBI:9158
Supplier Information
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Formula
C11H14O4
Net Charge
0
Average Mass
210.22650
Monoisotopic Mass
210.08921
InChI
InChI=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
InChIKey
LZFOPEXOUVTGJS-UHFFFAOYSA-N
SMILES
COc1cc(C=CCO)cc(OC)c1O
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
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
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
Sources
Sinapic alcohol
ChemIDplus
Sinapoyl alcohol
KEGG COMPOUND
Sinapyl alcohol
KEGG COMPOUND
Manual Xref
Database
C02325
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
3084125
Reaxys Registry Number
Reaxys
537-33-7
CAS Registry Number
KEGG COMPOUND
537-33-7
CAS Registry Number
ChemIDplus
Citations
Types
Sources
22794913
PubMed citation
Europe PMC
23398235
PubMed citation
Europe PMC
24667164
PubMed citation
Europe PMC
Last Modified
06 July 2016