CHEBI:107242 - 2-[[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]acetic acid ethyl ester

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 2-[[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]acetic acid ethyl ester ChEBI ID CHEBI:107242 Stars This entity has been manually annotated by a third party. 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 C14H15NO5 Net Charge 0 Average Mass 277.273 Monoisotopic Mass 277.09502 InChI InChI=1S/C14H15NO5/c1-2-18-14(17)8-15-13(16)6-4-10-3-5-11-12(7-10)20-9-19-11/h3-7H,2,8-9H2,1H3,(H,15,16) InChIKey WYFWERIPJKVISX-UHFFFAOYSA-N SMILES CCOC(=O)CNC(=O)C=CC1=CC2=C(C=C1)OCO2 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-[[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]acetic acid ethyl ester (CHEBI:107242) is a N-acyl-amino acid (CHEBI:51569) Manual Xref Database LSM-18596 LINCS View more database links