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CHEBI:83307 - (2S,5R)-4-dodecyl-2,5-dimethylmorpholine

ChEBI IDCHEBI:83307
ChEBI Name(2S,5R)-4-dodecyl-2,5-dimethylmorpholine
Stars
ASCII Name(2S,5R)-4-dodecyl-2,5-dimethylmorpholine
DefinitionA 4-dodecyl-2,5-dimethylmorpholine in which the stereocentre adjacent to the oxygen has S configuration, whilst that adjacent to the nitrogen has R configuration.
Last Modified14 October 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC18H37NO
Net Charge0
Average Mass283.500
Monoisotopic Mass283.28751
SMILESCCCCCCCCCCCCN1C[C@H](C)OC[C@H]1C
InChIInChI=1S/C18H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-18(3)20-16-17(19)2/h17-18H,4-16H2,1-3H3/t17-,18+/m1/s1
InChIKeyZFZYQMQYEVIHMY-MSOLQXFVSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(2S,5R)-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83307) is a 4-dodecyl-2,5-dimethylmorpholine (CHEBI:83299)
(2S,5R)-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83307) is enantiomer of (2R,5S)-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83306)
Incoming Relation(s)
rac-trans-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83311) has part (2S,5R)-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83307)
(2R,5S)-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83306) is enantiomer of (2S,5R)-4-dodecyl-2,5-dimethylmorpholine (CHEBI:83307)
IUPAC Name 
(2S,5R)-4-dodecyl-2,5-dimethylmorpholine