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CHEBI:76223 - 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

ChEBI IDCHEBI:76223
ChEBI Name5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
Stars
ASCII Name5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
DefinitionA member of the class of pyrrolizines that is 2,3-dihydro-1H-pyrrolizine which is substituted at positions 1 and 5 by carboxy and benzoyl groups, respectively.
Last Modified24 February 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC15H13NO3
Net Charge0
Average Mass255.273
Monoisotopic Mass255.08954
SMILESO=C(c1ccccc1)c1ccc2n1CCC2C(=O)O
InChIInChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)
InChIKeyOZWKMVRBQXNZKK-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid (CHEBI:76223) is a amino acid (CHEBI:33709)
5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid (CHEBI:76223) is a aromatic ketone (CHEBI:76224)
5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid (CHEBI:76223) is a monocarboxylic acid (CHEBI:25384)
5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid (CHEBI:76223) is a pyrrolizines (CHEBI:38522)
Incoming Relation(s)
(R)-ketorolac (CHEBI:76227) is a 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid (CHEBI:76223)
(S)-ketorolac (CHEBI:76228) is a 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid (CHEBI:76223)
IUPAC Name 
5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
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