CHEBI:120887 - 5-bromo-2-furancarboxylic acid [2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester

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ChEBI Name 5-bromo-2-furancarboxylic acid [2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester
ChEBI ID CHEBI:120887
Stars This entity has been manually annotated by a third party.
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Formula C16H18BrNO5
Net Charge 0
Average Mass 384.222
Monoisotopic Mass 383.03684
InChI InChI=1S/C16H18BrNO5/c1-10-8-12(11(2)18(10)6-7-21-3)13(19)9-22-16(20)14-4-5-15(17)23-14/h4-5,8H,6-7,9H2,1-3H3
InChIKey XXVVYSHKWQZBNI-UHFFFAOYSA-N
SMILES CC1=CC(=C(N1CCOC)C)C(=O)COC(=O)C2=CC=C(O2)Br
ChEBI Ontology
Outgoing 5-bromo-2-furancarboxylic acid [2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester (CHEBI:120887) has functional parent 2-furoic acid (CHEBI:30845)
5-bromo-2-furancarboxylic acid [2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester (CHEBI:120887) is a carboxylic ester (CHEBI:33308)
Manual Xref Database
LSM-32330 LINCS
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