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CHEBI:197663 - Oblongolide O

ChEBI IDCHEBI:197663
ChEBI NameOblongolide O
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O3
Net Charge0
Average Mass236.311
Monoisotopic Mass236.14124
SMILESC[C@H]1CC[C@H]2[C@@H](C=C[C@@H]3COC(=O)[C@@]32C)[C@@H]1O
InChIInChI=1S/C14H20O3/c1-8-3-6-11-10(12(8)15)5-4-9-7-17-13(16)14(9,11)2/h4-5,8-12,15H,3,6-7H2,1-2H3/t8-,9+,10+,11-,12+,14-/m0/s1
InChIKeyQDXTYHGLUXVBDR-ZVBWPKDRSA-N
Species of MetaboliteComponentSourceComments
Phomopsisspecies XZ-26 (ncbitaxon:357842) - DOI (10.1002/ejoc.200801021)
ChEBI Ontology
Outgoing Relation(s)
Oblongolide O (CHEBI:197663) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(3aS,5aR,6R,7S,9aS,9bR)-6-hydroxy-7,9b-dimethyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[g][2]benzouran-1-one
Manual XrefsDatabases
78436252ChemSpider