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CHEBI:41635 - 4-[(4Z)-1-(CARBOXYMETHYL)-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-2-YL]-4-IMINOBUTANOIC ACID

Default Structure
ChEBI IDCHEBI:41635
ChEBI Name4-[(4Z)-1-(CARBOXYMETHYL)-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-2-YL]-4-IMINOBUTANOIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC16H15N3O6
Net Charge0
Average Mass345.311
Monoisotopic Mass345.09609
SMILES[H]/N=C(/C1=N/C(=C(\[H])c2c([H])c([H])c(O[H])c([H])c2[H])C(=O)N1C([H])([H])C(=O)O[H])C([H])([H])C([H])([H])C(=O)O[H]
InChIInChI=1S/C16H15N3O6/c17-11(5-6-13(21)22)15-18-12(16(25)19(15)8-14(23)24)7-9-1-3-10(20)4-2-9/h1-4,7,17,20H,5-6,8H2,(H,21,22)(H,23,24)/b12-7+,17-11+
InChIKeyHQWMTGYOYORUQE-KNIBQTQZSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[(4Z)-1-(CARBOXYMETHYL)-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-2-YL]-4-IMINOBUTANOIC ACID (CHEBI:41635) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-[(4Z)-1-(CARBOXYMETHYL)-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-2-YL]-4-IMINOBUTANOIC ACIDPDBeChem
(4Z)-4-{(4E)-1-(carboxymethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}-4-iminobutanoic acidPDBeChem
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