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CHEBI:218827 - Obscurolide A2

Default Structure
ChEBI IDCHEBI:218827
ChEBI NameObscurolide A2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H17NO4
Net Charge0
Average Mass275.304
Monoisotopic Mass275.11576
SMILESCC(O)/C=C/C1OC(=O)CC1Nc1ccc(C=O)cc1
InChIInChI=1S/C15H17NO4/c1-10(18)2-7-14-13(8-15(19)20-14)16-12-5-3-11(9-17)4-6-12/h2-7,9-10,13-14,16,18H,8H2,1H3/b7-2+
InChIKeyRYJWSNUDETVRFF-FARCUNLSSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (1325435)
ChEBI Ontology
Outgoing Relation(s)
Obscurolide A2 (CHEBI:218827) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-[[2-[(E)-3-hydroxybut-1-enyl]-5-oxooxolan-3-yl]amino]benzaldehyde
Manual XrefsDatabases
4578602ChemSpider