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CHEBI:182298 - 3-hydroxy-2-[[1-[2-[(4-hydroxybenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]benzoic acid

ChEBI IDCHEBI:182298
ChEBI Name3-hydroxy-2-[[1-[2-[(4-hydroxybenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]benzoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H27N3O7
Net Charge0
Average Mass469.494
Monoisotopic Mass469.18490
SMILESCC(C)C(NC(=O)c1ccc(O)cc1)C(=O)N1CCCC1C(=O)Nc1c(O)cccc1C(=O)O
InChIInChI=1S/C24H27N3O7/c1-13(2)19(25-21(30)14-8-10-15(28)11-9-14)23(32)27-12-4-6-17(27)22(31)26-20-16(24(33)34)5-3-7-18(20)29/h3,5,7-11,13,17,19,28-29H,4,6,12H2,1-2H3,(H,25,30)(H,26,31)(H,33,34)
InChIKeyIVYXJYNRIKSGRV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
3-hydroxy-2-[[1-[2-[(4-hydroxybenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]benzoic acid (CHEBI:182298) is a dipeptide (CHEBI:46761)
IUPAC Name 
3-hydroxy-2-[[1-[2-[(4-hydroxybenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]benzoic acid
Manual XrefsDatabases
22943218ChemSpider