CHEBI:229777 - pre-putrebactin zwitterion

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ChEBI Name pre-putrebactin zwitterion ChEBI ID CHEBI:229777 Definition A zwitterion obtained by transfer of a proton from the carboxy group to the amino group of pre-putrebactin; Major microspecies at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C16H30N4O7 Net Charge 0 Average Mass 390.437 Monoisotopic Mass 390.21145 InChI InChI=1S/C16H30N4O7/c17-9-1-3-11-19(26)14(22)6-5-13(21)18-10-2-4-12-20(27)15(23)7-8-16(24)25/h26-27H,1-12,17H2,(H,18,21)(H,24,25) InChIKey MMTPETIUERTJQL-UHFFFAOYSA-N SMILES [NH3+]CCCCN(O)C(=O)CCC(=O)NCCCCN(O)C(=O)CCC([O-])=O ChEBI Ontology Outgoing pre-putrebactin zwitterion (CHEBI:229777) is a zwitterion (CHEBI:27369) pre-putrebactin zwitterion (CHEBI:229777) is tautomer of pre-putrebactin (CHEBI:50431) Incoming pre-putrebactin (CHEBI:50431) is tautomer of pre-putrebactin zwitterion (CHEBI:229777) IUPAC Name 4-[(4-{4-[(4-azaniumylbutyl)(hydroxy)amino]-4-oxobutanamido}butyl)(hydroxy)amino]-4-oxobutanoate Synonym Source pre-putrebactin UniProt Citation Type Source 18630910 PubMed citation SUBMITTER Last Modified 25 March 2024