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CHEBI:200939 - Oblongolide U

ChEBI IDCHEBI:200939
ChEBI NameOblongolide U
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O4
Net Charge0
Average Mass280.364
Monoisotopic Mass280.16746
SMILESC[C@H]1CC[C@H]2[C@@H](C=C[C@]3(O)CO[C@](C)(O)C(=O)[C@]23C)C1
InChIInChI=1S/C16H24O4/c1-10-4-5-12-11(8-10)6-7-16(19)9-20-15(3,18)13(17)14(12,16)2/h6-7,10-12,18-19H,4-5,8-9H2,1-3H3/t10-,11-,12-,14-,15-,16-/m0/s1
InChIKeyPKKIVBLVDYERIF-DNHGYJIUSA-N
Species of MetaboliteComponentSourceComments
Phomopsisspecies XZ-26 (ncbitaxon:357842) - DOI (10.1002/ejoc.200801021)
ChEBI Ontology
Outgoing Relation(s)
Oblongolide U (CHEBI:200939) is a organic heterotricyclic compound (CHEBI:26979)
Oblongolide U (CHEBI:200939) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(2S,4aR,6aR,8S,10aS,10bR)-2,4a-dihydroxy-2,8,10b-trimethyl-6a,7,8,9,10,10a-hexahydro-4H-benzo[]isochromen-1-one
Manual XrefsDatabases
78436696ChemSpider