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CHEBI:67778 - (E)-Adrienyne, [rel(threo)]-

ChEBI IDCHEBI:67778
ChEBI Name(E)-Adrienyne, [rel(threo)]-
Stars
DefinitionA natural product found in Laurencia marilzae.
Last Modified22 September 2014
DownloadsMolfile
FormulaC15H21BrCl2O
Net Charge0
Average Mass368.142
Monoisotopic Mass366.01528
SMILESC#C/C=C/C[C@@H](O)[C@H](Cl)C/C=C\C[C@@H](Cl)[C@H](Br)CC
InChIInChI=1S/C15H21BrCl2O/c1-3-5-6-11-15(19)14(18)10-8-7-9-13(17)12(16)4-2/h1,5-8,12-15,19H,4,9-11H2,2H3/b6-5+,8-7-/t12-,13-,14-,15-/m1/s1
InChIKeyGGOGTQISOAHDFM-OOCSKMCJSA-N
Species of MetaboliteComponentSourceComments
Laurencia marilzae (ncbitaxon:99905) - PubMed (21338119) CH2Cl2/MeOH(1:1,v/v) extract of fresh alga and E-isomer of Adrienyne
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(E)-Adrienyne, [rel(threo)]- (CHEBI:67778) has role metabolite (CHEBI:25212)
(E)-Adrienyne, [rel(threo)]- (CHEBI:67778) is a alcohol (CHEBI:30879)
(E)-Adrienyne, [rel(threo)]- (CHEBI:67778) is a organochlorine compound (CHEBI:36683)
Citations