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CHEBI:117141 - 4-[2-[(2,6-dimethoxyphenyl)-oxomethoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester

ChEBI IDCHEBI:117141
ChEBI Name4-[2-[(2,6-dimethoxyphenyl)-oxomethoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester
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DownloadsMolfile
FormulaC20H23NO7
Net Charge0
Average Mass389.404
Monoisotopic Mass389.14745
SMILESCCOC(=O)c1c(C)nc(C)c1C(=O)COC(=O)c1c(OC)cccc1OC
InChIInChI=1S/C20H23NO7/c1-6-27-19(23)17-12(3)21-11(2)16(17)13(22)10-28-20(24)18-14(25-4)8-7-9-15(18)26-5/h7-9,21H,6,10H2,1-5H3
InChIKeyHNAIESRUZRPIHU-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-[2-[(2,6-dimethoxyphenyl)-oxomethoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester (CHEBI:117141) is a methoxybenzoic acid (CHEBI:25238)
Manual XrefsDatabases
LSM-28590LINCS