CHEBI:172465 - 3,4,5-Trimethoxyphenyl acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3,4,5-Trimethoxyphenyl acetate
ChEBI ID CHEBI:172465
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H14O5
Net Charge 0
Average Mass 226.228
Monoisotopic Mass 226.08412
InChI InChI=1S/C11H14O5/c1-7(12)16-8-5-9(13-2)11(15-4)10(6-8)14-3/h5-6H,1-4H3
InChIKey ASPRESJSDRJZBN-UHFFFAOYSA-N
SMILES O(C1=C(OC)C=C(OC(=O)C)C=C1OC)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 3,4,5-Trimethoxyphenyl acetate (CHEBI:172465) is a benzoate ester (CHEBI:36054)
3,4,5-Trimethoxyphenyl acetate (CHEBI:172465) is a phenols (CHEBI:33853)
IUPAC Name
(3,4,5-trimethoxyphenyl) acetate
Manual Xrefs Databases
243126 ChemSpider
HMDB0031722 HMDB
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