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CHEBI:57301 - dihydroclavaminic acid zwitterion

ChEBI IDCHEBI:57301
ChEBI Namedihydroclavaminic acid zwitterion
Stars
DefinitionZwitterionic form of dihydroclavaminic acid.
Last Modified11 July 2014
DownloadsMolfile
FormulaC8H12N2O4
Net Charge0
Average Mass200.194
Monoisotopic Mass200.07971
SMILES[H][C@]12CC(=O)N1[C@H](C(=O)[O-])[C@@H](CC[NH3+])O2
InChIInChI=1S/C8H12N2O4/c9-2-1-4-7(8(12)13)10-5(11)3-6(10)14-4/h4,6-7H,1-3,9H2,(H,12,13)/t4-,6+,7+/m1/s1
InChIKeyBONQGFBLZGPXMG-PIYBLCFFSA-N
ChEBI Ontology
Outgoing Relation(s)
dihydroclavaminic acid zwitterion (CHEBI:57301) is a amino-acid zwitterion (CHEBI:35238)
dihydroclavaminic acid zwitterion (CHEBI:57301) is tautomer of dihydroclavaminic acid (CHEBI:15424)
Incoming Relation(s)
dihydroclavaminic acid (CHEBI:15424) is tautomer of dihydroclavaminic acid zwitterion (CHEBI:57301)
IUPAC Name 
(2S,3R,5S)-3-(2-azaniumylethyl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
UniProt Name  Source
dihydroclavaminateUniProt