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CHEBI:186245 - S-4-benzyl-3-((S)-3-hydroxy-2,2-dimethyloctanoyl)oxazolidin-2-one

ChEBI IDCHEBI:186245
ChEBI NameS-4-benzyl-3-((S)-3-hydroxy-2,2-dimethyloctanoyl)oxazolidin-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H29NO4
Net Charge0
Average Mass347.455
Monoisotopic Mass347.20966
SMILESCCCCC[C@H](O)C(C)(C)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1
InChIInChI=1S/C20H29NO4/c1-4-5-7-12-17(22)20(2,3)18(23)21-16(14-25-19(21)24)13-15-10-8-6-9-11-15/h6,8-11,16-17,22H,4-5,7,12-14H2,1-3H3/t16-,17-/m0/s1
InChIKeyBOLGBOZCCGUULF-IRXDYDNUSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
S-4-benzyl-3-((S)-3-hydroxy-2,2-dimethyloctanoyl)oxazolidin-2-one (CHEBI:186245) is a oxazolidinone (CHEBI:55374)
IUPAC Name 
(4S)-4-benzyl-3-[(3S)-3-hydroxy-2,2-dimethyloctanoyl]-1,3-oxazolidin-2-one