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CHEBI:209549 - 3,4-deoxy-3,4-didehydromultiplolide A

ChEBI IDCHEBI:209549
ChEBI Name3,4-deoxy-3,4-didehydromultiplolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H14O4
Net Charge0
Average Mass198.218
Monoisotopic Mass198.08921
SMILESC[C@H]1C[C@H](O)[C@H](O)/C=C/C=C\C(=O)O1
InChIInChI=1S/C10H14O4/c1-7-6-9(12)8(11)4-2-3-5-10(13)14-7/h2-5,7-9,11-12H,6H2,1H3/b4-2+,5-3-/t7-,8+,9-/m0/s1
InChIKeySAZJFRBQDIBJEF-NLCJYVHKSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - DOI (10.1002/hlca.200790190)
ChEBI Ontology
Outgoing Relation(s)
3,4-deoxy-3,4-didehydromultiplolide A (CHEBI:209549) is a oxacycle (CHEBI:38104)
IUPAC Name 
(2S,4S,5R,6E,8Z)-4,5-dihydroxy-2-methyl-2,3,4,5-tetrahydrooxecin-10-one
Manual XrefsDatabases
78437939ChemSpider