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CHEBI:83300 - (2S,6S)-4-dodecyl-2,6-dimethylmorpholine

ChEBI IDCHEBI:83300
ChEBI Name(2S,6S)-4-dodecyl-2,6-dimethylmorpholine
Stars
ASCII Name(2S,6S)-4-dodecyl-2,6-dimethylmorpholine
DefinitionA 4-dodecyl-2,6-dimethylmorpholine in which both stereocentres have S configuration.
Last Modified14 October 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC18H37NO
Net Charge0
Average Mass283.500
Monoisotopic Mass283.28751
SMILESCCCCCCCCCCCCN1C[C@H](C)O[C@@H](C)C1
InChIInChI=1S/C18H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-17(2)20-18(3)16-19/h17-18H,4-16H2,1-3H3/t17-,18-/m0/s1
InChIKeySBUKOHLFHYSZNG-ROUUACIJSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
Application:
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
ChEBI Ontology
Outgoing Relation(s)
(2S,6S)-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83300) is a 4-dodecyl-2,6-dimethylmorpholine (CHEBI:83297)
(2S,6S)-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83300) is enantiomer of (2R,6R)-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83301)
Incoming Relation(s)
rac-trans-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83302) has part (2S,6S)-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83300)
(2R,6R)-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83301) is enantiomer of (2S,6S)-4-dodecyl-2,6-dimethylmorpholine (CHEBI:83300)
IUPAC Name 
(S,S)-4-dodecyl-2,6-dimethylmorpholine
Synonyms  Source
(S,S)-4-dodecyl-2,6-dimethylmorpholineChEBI
(2S,trans)-4-dodecyl-2,6-dimethylmorpholineChEBI