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CHEBI:47412 - N-[4-(2-{2-[3-(2-BROMO-ACETYLAMINO)-PROPIONYLAMINO]-3-HYDROXY-PROPIONYLAMINO}-ETHYL)-PHENYL]-OXALAMIC ACID

Default Structure
ChEBI IDCHEBI:47412
ChEBI NameN-[4-(2-{2-[3-(2-BROMO-ACETYLAMINO)-PROPIONYLAMINO]-3-HYDROXY-PROPIONYLAMINO}-ETHYL)-PHENYL]-OXALAMIC ACID
Stars
DownloadsMolfile
FormulaC18H23BrN4O7
Net Charge0
Average Mass487.307
Monoisotopic Mass486.07501
SMILES[H]OC(=O)C(=O)N([H])c1c([H])c([H])c(C([H])([H])C([H])([H])N([H])C(=O)[C@@]([H])(N([H])C(=O)C([H])([H])C([H])([H])N([H])C(=O)C([H])([H])Br)C([H])([H])O[H])c([H])c1[H]
InChIInChI=1S/C18H23BrN4O7/c19-9-15(26)20-8-6-14(25)23-13(10-24)16(27)21-7-5-11-1-3-12(4-2-11)22-17(28)18(29)30/h1-4,13,24H,5-10H2,(H,20,26)(H,21,27)(H,22,28)(H,23,25)(H,29,30)/t13-/m0/s1
InChIKeyIYAWTDCWUJJPHZ-ZDUSSCGKSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[4-(2-{2-[3-(2-BROMO-ACETYLAMINO)-PROPIONYLAMINO]-3-HYDROXY-PROPIONYLAMINO}-ETHYL)-PHENYL]-OXALAMIC ACID (CHEBI:47412) is a unclassifieds (CHEBI:27189)
Synonyms  Source
N-[4-(2-{2-[3-(2-BROMO-ACETYLAMINO)-PROPIONYLAMINO]-3-HYDROXY-PROPIONYLAMINO}-ETHYL)-PHENYL]-OXALAMIC ACIDPDBeChem
N-(bromoacetyl)-beta-alanyl-N-(2-{4-[(carboxycarbonyl)amino]phenyl}ethyl)-L-serinamidePDBeChem
Manual XrefsDatabases
FG1PDBeChem