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CHEBI:189336 - Brasilamide M

ChEBI IDCHEBI:189336
ChEBI NameBrasilamide M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H19NO5
Net Charge0
Average Mass293.319
Monoisotopic Mass293.12632
SMILES[H][C@]12CC[C@]3(CO)OC(=O)[C@@]1(CC(=O)/C=C(\C)C(N)=O)[C@]3([H])C2
InChIInChI=1S/C15H19NO5/c1-8(12(16)19)4-10(18)6-15-9-2-3-14(7-17,11(15)5-9)21-13(15)20/h4,9,11,17H,2-3,5-7H2,1H3,(H2,16,19)/b8-4+/t9-,11-,14-,15-/m1/s1
InChIKeyBXWBZJGYSPICSH-VIOBQLPWSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
Paraconiothyrium brasiliense (ncbitaxon:300254) - PubMed (26274948)
ChEBI Ontology
Outgoing Relation(s)
Brasilamide M (CHEBI:189336) is a terpene lactone (CHEBI:37668)
IUPAC Names 
(E)-5-[(1S,3R,6S,9R)-6-(hydroxymethyl)-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl]-2-methyl-4-oxopent-2-enamide
(E)-5-[(1S,3S,6R,9S)-6-(hydroxymethyl)-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl]-2-methyl-4-oxopent-2-enamide
Manual XrefsDatabases
78436273ChemSpider