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CHEBI:120694 - 3-(1H-indol-3-yl)propanoic acid [2-[tert-butyl-(phenylmethyl)amino]-2-oxoethyl] ester

ChEBI IDCHEBI:120694
ChEBI Name3-(1H-indol-3-yl)propanoic acid [2-[tert-butyl-(phenylmethyl)amino]-2-oxoethyl] ester
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FormulaC24H28N2O3
Net Charge0
Average Mass392.499
Monoisotopic Mass392.20999
SMILESCC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)CCc1cnc2ccccc12
InChIInChI=1S/C24H28N2O3/c1-24(2,3)26(16-18-9-5-4-6-10-18)22(27)17-29-23(28)14-13-19-15-25-21-12-8-7-11-20(19)21/h4-12,15,25H,13-14,16-17H2,1-3H3
InChIKeyHZXOWBLBPRWBTK-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)
3-(1H-indol-3-yl)propanoic acid [2-[tert-butyl-(phenylmethyl)amino]-2-oxoethyl] ester (CHEBI:120694) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-32136LINCS