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CHEBI:191375 - (4R,5R)-isocycloseram

ChEBI IDCHEBI:191375
ChEBI Name(4R,5R)-isocycloseram
Stars
ASCII Name(4R,5R)-isocycloseram
DefinitionThe (4R,5R)-stereoisomer of isocycloseram.
Last Modified9 September 2022
SubmitterAdnan
DownloadsMolfile
FormulaC23H19Cl2F4N3O4
Net Charge0
Average Mass548.320
Monoisotopic Mass547.06887
SMILESCCN1OC[C@@H](NC(=O)c2ccc(C3=NO[C@](c4cc(Cl)c(F)c(Cl)c4)(C(F)(F)F)C3)cc2C)C1=O
InChIInChI=1S/C23H19Cl2F4N3O4/c1-3-32-21(34)18(10-35-32)30-20(33)14-5-4-12(6-11(14)2)17-9-22(36-31-17,23(27,28)29)13-7-15(24)19(26)16(25)8-13/h4-8,18H,3,9-10H2,1-2H3,(H,30,33)/t18-,22-/m1/s1
InChIKeyWLSQDEYDCAGPIR-XMSQKQJNSA-N
ChEBI Ontology
Outgoing Relation(s)
(4R,5R)-isocycloseram (CHEBI:191375) is a 4-[5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydro-1,2-oxazol-3-yl]-N-(2-ethyl-3-oxo-1,2-oxazolidin-4-yl)-2-methylbenzamide (CHEBI:191378)
Incoming Relation(s)
isocycloseram (CHEBI:191373) has part (4R,5R)-isocycloseram (CHEBI:191375)
IUPAC Name 
4-[(5R)-5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydro-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide
Synonym  Source
(5R,4R)-isocycloseramChEBI
Registry NumbersSources
CAS:1309958-03-9ChemIDplus