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CHEBI:208912 - Pestalotiolactone C

ChEBI IDCHEBI:208912
ChEBI NamePestalotiolactone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O4
Net Charge0
Average Mass200.234
Monoisotopic Mass200.10486
SMILESC[C@@H]1[C@H]2[C@@H](C[C@]1(C)O)OC(=O)[C@]2(C)O
InChIInChI=1S/C10H16O4/c1-5-7-6(4-9(5,2)12)14-8(11)10(7,3)13/h5-7,12-13H,4H2,1-3H3/t5-,6-,7+,9+,10-/m1/s1
InChIKeyORCDXOHZCRZPRS-FOWOUKQUSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31569593)
ChEBI Ontology
Outgoing Relation(s)
Pestalotiolactone C (CHEBI:208912) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(3R,3aS,4R,5S,6aR)-3,5-dihydroxy-3,4,5-trimethyl-3a,4,6,6a-tetrahydrocyclopenta[b]uran-2-one
Manual XrefsDatabases
81361090ChemSpider