CHEBI:16239 - benzyl (2R,3S)-3-hydroxy-2-methylbutanoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name benzyl (2R,3S)-3-hydroxy-2-methylbutanoate
ChEBI ID CHEBI:16239
ChEBI ASCII Name benzyl (2R,3S)-3-hydroxy-2-methylbutanoate
Definition The (2R,3S)-stereoisomer of benzyl 2-methyl-3-hydroxybutanoate.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3050, CHEBI:22739, CHEBI:13886
Supplier Information
Download Molfile XML SDF
Formula C12H16O3
Net Charge 0
Average Mass 208.25364
Monoisotopic Mass 208.10994
InChI InChI=1S/C12H16O3/c1-9(10(2)13)12(14)15-8-11-6-4-3-5-7-11/h3-7,9-10,13H,8H2,1-2H3/t9-,10+/m1/s1
InChIKey VDARBCCMTDKLBW-ZJUUUORDSA-N
SMILES C[C@H](O)[C@@H](C)C(=O)OCc1ccccc1
ChEBI Ontology
Outgoing benzyl (2R,3S)-3-hydroxy-2-methylbutanoate (CHEBI:16239) is a benzyl 2-methyl-3-hydroxybutanoate (CHEBI:22748)
IUPAC Name
benzyl (2R,3S)-3-hydroxy-2-methylbutanoate
Synonyms Sources
Benzyl (2R,3S)-2-methyl-3-hydroxybutanoate KEGG COMPOUND
benzyl (2R,3S)-2-methyl-3-hydroxybutanoate UniProt
Manual Xref Database
C04561 KEGG COMPOUND
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Last Modified
13 November 2017