CHEBI:59958 - (3S,6E)-nerolidol

ChEBI IDCHEBI:59958
ChEBI Name(3S,6E)-nerolidol
Stars
ASCII Name(3S,6E)-nerolidol
DefinitionA (6E)-nerolidol in which the hydroxy group at positon 3 adopts an S-configuration.
Last Modified4 June 2021
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILESC=C[C@@](C)(O)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+/t15-/m1/s1
InChIKeyFQTLCLSUCSAZDY-ATGUSINASA-N
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
insect attractant  A chemical that attracts insects.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
pheromone  A semiochemical used in olfactory communication between organisms of the same species eliciting a change in sexual or social behaviour.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
Applications:
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
herbicide  A substance used to destroy plant pests.
cosmetic  The role played by a substance in enhancing the appearance or odour of the human body; a name given to the substance itself or to a component of it.
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
(3S,6E)-nerolidol (CHEBI:59958) is a (6E)-nerolidol (CHEBI:141283)
(3S,6E)-nerolidol (CHEBI:59958) is enantiomer of (3R,6E)-nerolidol (CHEBI:59959)
Incoming Relation(s)
(3R,6E)-nerolidol (CHEBI:59959) is enantiomer of (3S,6E)-nerolidol (CHEBI:59958)
IUPAC Name 
(3S,6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol
Synonyms  Source
(S-(E))-3,7,11-trimethyldodeca-1,6,10-trien-3-olChemIDplus
(3S,6E)-NerolidolKEGG COMPOUND
UniProt Name  Source
(3S,6E)-nerolidolUniProt
Manual XrefsDatabases
LMPR0103010005LIPID MAPS
C09704KEGG COMPOUND
4444858ChemSpider
Registry NumbersSources
Beilstein:5248349Beilstein
CAS:1119-38-6ChemIDplus
Citations