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ChEBI
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CHEBI:76229 - ketorolac(1−)
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ChEBI Name
ketorolac(1−)
ChEBI ID
CHEBI:76229
ChEBI ASCII Name
ketorolac(1-)
Definition
A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of ketorolac. The major species at pH 7.3.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C15H12NO3
Net Charge
-1
Average Mass
254.26070
Monoisotopic Mass
254.08227
InChI
InChI=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)
/p-
1
InChIKey
OZWKMVRBQXNZKK-UHFFFAOYSA-M
SMILES
[O-]C(=O)C1CCn2c1ccc2C(=O)c1ccccc1
ChEBI Ontology
Outgoing
ketorolac(1−) (
CHEBI:76229
)
is a
amino-acid anion (
CHEBI:37022
)
ketorolac(1−) (
CHEBI:76229
)
is a
monocarboxylic acid anion (
CHEBI:35757
)
ketorolac(1−) (
CHEBI:76229
)
is conjugate base of
ketorolac (
CHEBI:6129
)
Incoming
ketorolac tromethamine (
CHEBI:6130
)
has part
ketorolac(1−) (
CHEBI:76229
)
ketorolac (
CHEBI:6129
)
is conjugate acid of
ketorolac(1−) (
CHEBI:76229
)
IUPAC Name
rac
-5-benzoyl-2,3-dihydro-1
H
-pyrrolizine-1-carboxylate
Last Modified
08 November 2013