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CHEBI:155896 - benzyl 2,5-dihydroxybenzoate
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ChEBI Name
benzyl 2,5-dihydroxybenzoate
ChEBI ID
CHEBI:155896
Definition
A benzoate ester resulting from the formal condensation of the carboxy group of 2,5-dihydroxybenzoic acid with the hydroxy group of phenylmethanol.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Mark Williams
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Formula
C14H12O4
Net Charge
0
Average Mass
244.246
Monoisotopic Mass
244.07356
InChI
InChI=1S/C14H12O4/c15-11-6-7-13(16)12(8-11)14(17)18-9-10-4-2-1-3-5-10/h1-8,15-16H,9H2
InChIKey
LRYANVPYFCKCCR-UHFFFAOYSA-N
SMILES
OC1=C(C(OCC=2C=CC=CC2)=O)C=C(O)C=C1
Metabolite of Species
Details
Paeonia lactiflora
(NCBI:txid35924)
Found in root
(BTO:0001188)
. 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
benzyl 2,5-dihydroxybenzoate (
CHEBI:155896
)
has functional parent
2,5-dihydroxybenzoic acid (
CHEBI:17189
)
benzyl 2,5-dihydroxybenzoate (
CHEBI:155896
)
has role
plant metabolite (
CHEBI:76924
)
benzyl 2,5-dihydroxybenzoate (
CHEBI:155896
)
is a
benzoate ester (
CHEBI:36054
)
benzyl 2,5-dihydroxybenzoate (
CHEBI:155896
)
is a
benzyl ester (
CHEBI:90628
)
benzyl 2,5-dihydroxybenzoate (
CHEBI:155896
)
is a
phenols (
CHEBI:33853
)
IUPAC Name
benzyl 2,5-dihydroxybenzoate
Synonyms
Sources
2,5-dihydroxybenzoic acid benzyl ester
ChEBI
benzyl gentisate
ChEBI
phenylmethyl 2,5-dihydroxybenzoate
ChEBI
trichocarpigenin
ChEBI
trichocarpinene
ChEBI
Registry Number
Type
Source
21782-87-6
CAS Registry Number
ChEBI
Citation
Type
Source
28901069
PubMed citation
Europe PMC
Last Modified
19 June 2020