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CHEBI:211918 - Pentalenolactone H

ChEBI IDCHEBI:211918
ChEBI NamePentalenolactone H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O6
Net Charge0
Average Mass294.303
Monoisotopic Mass294.11034
SMILESCC1(C)C[C@@]23[C@H](C=C(C(=O)O)[C@@H]2COC(=O)[C@]32CO2)[C@H]1O
InChIInChI=1S/C15H18O6/c1-13(2)5-14-8(10(13)16)3-7(11(17)18)9(14)4-20-12(19)15(14)6-21-15/h3,8-10,16H,4-6H2,1-2H3,(H,17,18)/t8-,9+,10-,14-,15-/m1/s1
InChIKeyDLKAFAGJFDQQFA-OQMGSFEQSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - DOI (10.1016/S0040-4039(01)95238-4)
ChEBI Ontology
Outgoing Relation(s)
Pentalenolactone H (CHEBI:211918) is a δ-lactone (CHEBI:18946)
IUPAC Name 
(1R,4aR,6aS,7R,9aS)-7-hydroxy-8,8-dimethyl-2-oxospiro[4a,6a,7,9-tetrahydro-4H-pentaleno[1,6a-c]pyran-1,2'-oxirane]-5-carboxylic acid