CHEBI:58692 - (R)-2-benzylsuccinate

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ChEBI Name (R)-2-benzylsuccinate
ChEBI ID CHEBI:58692
ChEBI ASCII Name (R)-2-benzylsuccinate
Definition Dicarboxylate anion of (R)-2-benzylsuccinic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11H10O4
Net Charge -2
Average Mass 206.19470
Monoisotopic Mass 206.05791
InChI InChI=1S/C11H12O4/c12-10(13)7-9(11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)/p-2/t9-/m1/s1
InChIKey GTOFKXZQQDSVFH-SECBINFHSA-L
SMILES [O-]C(=O)C[C@@H](Cc1ccccc1)C([O-])=O
Roles Classification
Biological Role(s): bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
(via 2-benzylsuccinate(2-) )
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ChEBI Ontology
Outgoing (R)-2-benzylsuccinate (CHEBI:58692) is a 2-benzylsuccinate(2−) (CHEBI:57621)
(R)-2-benzylsuccinate (CHEBI:58692) is a dicarboxylic acid dianion (CHEBI:28965)
(R)-2-benzylsuccinate (CHEBI:58692) is conjugate base of 2-benzylsuccinic acid (CHEBI:16054)
(R)-2-benzylsuccinate (CHEBI:58692) is enantiomer of (S)-2-benzylsuccinate (CHEBI:188358)
Incoming 2-benzylsuccinic acid (CHEBI:16054) is conjugate acid of (R)-2-benzylsuccinate (CHEBI:58692)
(S)-2-benzylsuccinate (CHEBI:188358) is enantiomer of (R)-2-benzylsuccinate (CHEBI:58692)
IUPAC Name
(2R)-2-benzylbutanedioate
Synonym Source
(R)-2-benzylsuccinate UniProt
Last Modified
13 December 2021