CHEBI:156575 - 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one
ChEBI ID CHEBI:156575
Definition A member of the class of oxazolidinones that is 5-(hydroxymethyl)-1,3-oxazolidin-2-one substituted by a 3-methylphenyl group at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11H13NO3
Net Charge 0
Average Mass 207.229
Monoisotopic Mass 207.08954
InChI InChI=1S/C11H13NO3/c1-8-3-2-4-9(5-8)12-6-10(7-13)15-11(12)14/h2-5,10,13H,6-7H2,1H3
InChIKey MXUNKHLAEDCYJL-UHFFFAOYSA-N
SMILES CC1=CC=CC(=C1)N1CC(CO)OC1=O
ChEBI Ontology
Outgoing 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (CHEBI:156575) is a oxazolidinone (CHEBI:55374)
5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (CHEBI:156575) is a primary alcohol (CHEBI:15734)
5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (CHEBI:156575) is a toluenes (CHEBI:27024)
Incoming (R)-toloxatone (CHEBI:156573) is a 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (CHEBI:156575)
(S)-toloxatone (CHEBI:156574) is a 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (CHEBI:156575)
IUPAC Name
5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one
Synonyms Sources
5-(hydroxymethyl)-3-(3-methylphenyl)-2-oxazolidinone ChEBI
5-hydroxymethyl-3-(m-tolyl)-2-oxazolidinone ChEBI
Last Modified
02 October 2020
General Comment
2020-10-02 This is the entry for material with unspecified stereochemistry. There are separate entries for the racemate (toloxatone) and its individual enantiomers, (R)- and (S)-toloxatane.