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CHEBI:206700 - Murranolide A

ChEBI IDCHEBI:206700
ChEBI NameMurranolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O6
Net Charge0
Average Mass258.270
Monoisotopic Mass258.11034
SMILESCO[C@@H](C[C@]1(OC)C=CC(=O)O1)[C@H]1O[C@H]1[C@H](C)O
InChIInChI=1S/C12H18O6/c1-7(13)10-11(17-10)8(15-2)6-12(16-3)5-4-9(14)18-12/h4-5,7-8,10-11,13H,6H2,1-3H3/t7-,8-,10-,11+,12-/m0/s1
InChIKeyINCMIDZCFLXDFG-TZAKJNRTSA-N
Species of MetaboliteComponentSourceComments
Curvularia (ncbitaxon:5502) - PubMed (28195475)
ChEBI Ontology
Outgoing Relation(s)
Murranolide A (CHEBI:206700) is a ketal (CHEBI:59777)
IUPAC Name 
(5R)-5-[(2S)-2-[(2R,3S)-3-[(1S)-1-hydroxyethyl]oxiran-2-yl]-2-methoxyethyl]-5-methoxyuran-2-one
Manual XrefsDatabases
78438911ChemSpider