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CHEBI:223200 - Isariotin L

ChEBI IDCHEBI:223200
ChEBI NameIsariotin L
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H33NO7
Net Charge0
Average Mass411.495
Monoisotopic Mass411.22570
SMILESO=C(/C=C/CCCCCCCCCO)N[C@H]1C[C@@]2(O[C@H]1O)C(=O)C=CC(O)C2O
InChIInChI=1S/C21H33NO7/c23-13-9-7-5-3-1-2-4-6-8-10-18(26)22-15-14-21(29-20(15)28)17(25)12-11-16(24)19(21)27/h8,10-12,15-16,19-20,23-24,27-28H,1-7,9,13-14H2,(H,22,26)/b10-8+/t15-,16?,19?,20+,21+/m0/s1
InChIKeyDQJCNOUNYPRLKJ-JYODQQALSA-N
Species of MetaboliteComponentSourceComments
Gibellula formosana (ncbitaxon:219212) - DOI (10.1016/j.tet.2012.05.020)
ChEBI Ontology
Outgoing Relation(s)
Isariotin L (CHEBI:223200) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(E)-12-hydroxy-N-[(2R,3S,5S)-2,9,10-trihydroxy-6-oxo-1-oxaspiro[4.5]dec-7-en-3-yl]dodec-2-enamide
Manual XrefsDatabases
78437717ChemSpider