CHEBI:212165 - 2-acetylamino-3-hydroxyl-4-methyl-benzoic acid methyl ester

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 2-acetylamino-3-hydroxyl-4-methyl-benzoic acid methyl ester
ChEBI ID CHEBI:212165
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H13NO4
Net Charge 0
Average Mass 223.228
Monoisotopic Mass 223.08446
InChI InChI=1S/C11H13NO4/c1-6-4-5-8(11(15)16-3)9(10(6)14)12-7(2)13/h4-5,14H,1-3H3,(H,12,13)
InChIKey RRVOWEWIOXYBDK-UHFFFAOYSA-N
SMILES O=C(OC)C1=C(NC(=O)C)C(O)=C(C)C=C1
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing 2-acetylamino-3-hydroxyl-4-methyl-benzoic acid methyl ester (CHEBI:212165) is a benzoate ester (CHEBI:36054)
2-acetylamino-3-hydroxyl-4-methyl-benzoic acid methyl ester (CHEBI:212165) is a phenols (CHEBI:33853)
IUPAC Name
methyl 2-acetamido-3-hydroxy-4-methylbenzoate
Manual Xref Database
58197362 ChemSpider
View more database links