Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:133564 -
D
-glucosyl salicylate
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
D
-glucosyl salicylate
ChEBI ID
CHEBI:133564
ChEBI ASCII Name
D-glucosyl salicylate
Definition
A benzoate ester resulting from the formal condensation of the carboxy group of salicylic acid with the anomeric hydroxy group of
D
-glucose.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C13H16O8
Net Charge
0
Average Mass
300.263
Monoisotopic Mass
300.08452
InChI
InChI=1S/C13H16O8/c14-
5-
8-
9(16)
10(17)
11(18)
13(20-
8)
21-
12(19)
6-
3-
1-
2-
4-
7(6)
15/h1-
4,8-
11,13-
18H,5H2/t8-
,9-
,10+,11-
,13?/m1/s1
InChIKey
XNHKMZHWRNMFCU-TWEVDUBQSA-N
SMILES
O1[C@@H]([C@H]([C@@H]([C@H](C1OC(C=2C(=CC=CC2)O)=O)O)O)O)CO
Metabolite of Species
Details
Arabidopsis thaliana
(NCBI:txid3702)
See:
MetaboLights Study
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
D
-glucosyl salicylate (
CHEBI:133564
)
has functional parent
salicylic acid (
CHEBI:16914
)
D
-glucosyl salicylate (
CHEBI:133564
)
has role
plant metabolite (
CHEBI:76924
)
D
-glucosyl salicylate (
CHEBI:133564
)
is a
O
-acyl carbohydrate (
CHEBI:52782
)
D
-glucosyl salicylate (
CHEBI:133564
)
is a
D
-glucoside (
CHEBI:35436
)
D
-glucosyl salicylate (
CHEBI:133564
)
is a
benzoate ester (
CHEBI:36054
)
D
-glucosyl salicylate (
CHEBI:133564
)
is a
phenols (
CHEBI:33853
)
Incoming
β-
D
-glucosyl salicylate (
CHEBI:145681
)
is a
D
-glucosyl salicylate (
CHEBI:133564
)
IUPAC Name
1-
O
-(2-hydroxybenzoyl)-
D
-glucopyranose
Synonyms
Sources
1-
O
-(2-hydroxybenzoyl)-
D
-glucose
ChEBI
1-
O
-salicyl-
D
-glucose
ChEBI
salicylate-
D
-glucose ester
ChEBI
Last Modified
06 January 2020