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CHEBI:45820 - methyl syringate
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ChEBI Ontology
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ChEBI Name
methyl syringate
ChEBI ID
CHEBI:45820
Definition
A benzoate ester obtained by the formal condensation of carboxy group of syringic acid with methanol.
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This entity has been manually annotated by the ChEBI Team.
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Molfile
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Formula
C10H12O5
Net Charge
0
Average Mass
212.19930
Monoisotopic Mass
212.06847
InChI
InChI=1S/C10H12O5/c1-13-7-4-6(10(12)15-3)5-8(14-2)9(7)11/h4-5,11H,1-3H3
InChIKey
ZMXJAEGJWHJMGX-UHFFFAOYSA-N
SMILES
COC(=O)c1cc(OC)c(O)c(OC)c1
Metabolite of Species
Details
Buxus natalensis
(IPNI:128681-1)
Found in bark
(BTO:0001301)
. MeOH extract of pulverized bark See:
PubMed
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
methyl syringate (
CHEBI:45820
)
has functional parent
syringic acid (
CHEBI:68329
)
methyl syringate (
CHEBI:45820
)
has role
plant metabolite (
CHEBI:76924
)
methyl syringate (
CHEBI:45820
)
is a
benzoate ester (
CHEBI:36054
)
methyl syringate (
CHEBI:45820
)
is a
dimethoxybenzene (
CHEBI:51681
)
methyl syringate (
CHEBI:45820
)
is a
phenols (
CHEBI:33853
)
IUPAC Name
methyl 4-hydroxy-3,5-dimethoxybenzoate
Synonym
Source
Syringic acid monomethyl ester
NIST Chemistry WebBook
Manual Xref
Database
SYR
PDBeChem
View more database links
Registry Numbers
Types
Sources
2217524
Reaxys Registry Number
Reaxys
884-35-5
CAS Registry Number
ChemIDplus
884-35-5
CAS Registry Number
NIST Chemistry WebBook
Citation
Type
Source
20954721
PubMed citation
Europe PMC
Last Modified
12 May 2015