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CHEBI:38413 - (S)-lamenallenic acid

ChEBI IDCHEBI:38413
ChEBI Name(S)-lamenallenic acid
Stars
ASCII Name(S)-lamenallenic acid
DefinitionThe (S)-enantiomer of lamenallenic acid.
Last Modified16 January 2020
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC18H30O2
Net Charge0
Average Mass278.436
Monoisotopic Mass278.22458
SMILES[H]C(=C=CCCCCCCCC/C=C/C)CCCC(=O)O
InChIInChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-3,12,14H,4-11,15-17H2,1H3,(H,19,20)/b3-2+/t13-/m1/s1
InChIKeyIHBRXZJPXHXMCN-YWVDXFKGSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(S)-lamenallenic acid (CHEBI:38413) is a lamenallenic acid (CHEBI:38396)
(S)-lamenallenic acid (CHEBI:38413) is enantiomer of (R)-lamenallenic acid (CHEBI:38403)
Incoming Relation(s)
(R)-lamenallenic acid (CHEBI:38403) is enantiomer of (S)-lamenallenic acid (CHEBI:38413)
IUPAC Name 
(5S,16E)-octadeca-5,6,16-trienoic acid
Synonyms  Source
(+)-lamenallenic acidChEBI
(+)-trans-5,6,16-octadecatrienoic acidChEBI
(+)-LamenallensäureChEBI
(R,E)-octadeca-5,6,16-trienoic acidChEBI
(+)-trans-octadeca-5,6,16-trienoic acidChEBI
(S,E)-5,6,16-octadecatrienoic acidChEBI
Registry NumbersSources
Reaxys:4136861Reaxys
Citations