CHEBI:121331 - 5-[[[(5-tert-butyl-2-methyl-3-furanyl)-oxomethyl]amino]methyl]-2-furancarboxylic acid ethyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-[[[(5-tert-butyl-2-methyl-3-furanyl)-oxomethyl]amino]methyl]-2-furancarboxylic acid ethyl ester
ChEBI ID CHEBI:121331
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H23NO5
Net Charge 0
Average Mass 333.380
Monoisotopic Mass 333.15762
InChI InChI=1S/C18H23NO5/c1-6-22-17(21)14-8-7-12(24-14)10-19-16(20)13-9-15(18(3,4)5)23-11(13)2/h7-9H,6,10H2,1-5H3,(H,19,20)
InChIKey BEEZNWLPFBEOPP-UHFFFAOYSA-N
SMILES CCOC(=O)C1=CC=C(O1)CNC(=O)C2=C(OC(=C2)C(C)(C)C)C
ChEBI Ontology
Outgoing 5-[[[(5-tert-butyl-2-methyl-3-furanyl)-oxomethyl]amino]methyl]-2-furancarboxylic acid ethyl ester (CHEBI:121331) has functional parent 2-furoic acid (CHEBI:30845)
5-[[[(5-tert-butyl-2-methyl-3-furanyl)-oxomethyl]amino]methyl]-2-furancarboxylic acid ethyl ester (CHEBI:121331) is a carboxylic ester (CHEBI:33308)
Manual Xref Database
LSM-32774 LINCS
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