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CHEBI:43959 - 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE

Default Structure
ChEBI IDCHEBI:43959
ChEBI Name1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE
Stars
DownloadsMolfile
FormulaC12H17NO2
Net Charge0
Average Mass207.273
Monoisotopic Mass207.12593
SMILES[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])c([H])c1[H]
InChIInChI=1S/C12H17NO2/c1-9(2)7-13-8-10-3-5-11(6-4-10)12(14)15/h3-6,9,13H,7-8H2,1-2H3,(H,14,15)
InChIKeyUHUHLFVTIXJYPG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE (CHEBI:43959) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENEPDBeChem
4-{[(2-methylpropyl)amino]methyl}benzoic acidPDBeChem
Manual XrefsDatabases
MN7PDBeChem