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CHEBI:228071 - Irpexlacte A

ChEBI IDCHEBI:228071
ChEBI NameIrpexlacte A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESC[C@@H]1[C@H]2C[C@H](C(C(=O)O)=C3CC(C)(C)C[C@@H]31)[C@@H](O)O2
InChIInChI=1S/C15H22O4/c1-7-9-5-15(2,3)6-10(9)12(13(16)17)8-4-11(7)19-14(8)18/h7-9,11,14,18H,4-6H2,1-3H3,(H,16,17)/t7-,8+,9+,11+,14-/m0/s1
InChIKeyHAJPBKJDHYPJHO-RDICWGLJSA-N
Species of MetaboliteComponentSourceComments
Irpex (ncbitaxon:5318) - DOI (10.1016/j.phytol.2019.06.001)
ChEBI Ontology
Outgoing Relation(s)
Irpexlacte A (CHEBI:228071) is a oxolanes (CHEBI:26912)
IUPAC Name 
(1R,7R,8S,9R,11S)-11-hydroxy-5,5,8-trimethyl-10-oxatricyclo[7.2.1.03,7]dodec-2-ene-2-carboxylic acid