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CHEBI:67774 - Marilzallene, (rel)-

ChEBI IDCHEBI:67774
ChEBI NameMarilzallene, (rel)-
Stars
DefinitionA natural product found in Laurencia marilzae.
Last Modified16 January 2020
DownloadsMolfile
FormulaC15H20BrClO2
Net Charge0
Average Mass347.680
Monoisotopic Mass346.03352
SMILESC/C=C/[C@H]1C/C=C\C[C@@H](Cl)[C@@H](C[C@@H](O)C=C=CBr)O1
InChIInChI=1S/C15H20BrClO2/c1-2-6-13-8-3-4-9-14(17)15(19-13)11-12(18)7-5-10-16/h2-4,6-7,10,12-15,18H,8-9,11H2,1H3/b4-3-,6-2+/t5?,12-,13-,14+,15+/m0/s1
InChIKeyUAKMIDIJYGIRKO-LFOVUXSZSA-N
Species of MetaboliteComponentSourceComments
Laurencia marilzae (ncbitaxon:99905) - PubMed (21338119) CH2Cl2/MeOH(1:1,v/v) extract of fresh alga
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)
Marilzallene, (rel)- (CHEBI:67774) has role metabolite (CHEBI:25212)
Marilzallene, (rel)- (CHEBI:67774) is a allenes (CHEBI:37602)
Marilzallene, (rel)- (CHEBI:67774) is a oxacycle (CHEBI:38104)
Synonym  Source
rel-(2R,3S)-5-Bromo-1-{(2R,3R,5Z,8R)-3-chloro-8-[(1E)-1-propen-1-yl]-3,4,7,8-tetrahydro-2H-oxocin-2-yl}-3,4-pentadien-2-olChEBI
Manual XrefsDatabases
27026674ChemSpider
Citations