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CHEBI:202530 - 1beta,13-dimethoxy-10alpha-hydroxyeremophil-7(11)-en-12,8beta-olide

ChEBI IDCHEBI:202530
ChEBI Name1beta,13-dimethoxy-10alpha-hydroxyeremophil-7(11)-en-12,8beta-olide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26O5
Net Charge0
Average Mass310.390
Monoisotopic Mass310.17802
SMILESCOCC1=C2C[C@]3(C)[C@@H](C)CC[C@@H](OC)[C@@]3(O)C[C@H]2OC1=O
InChIInChI=1S/C17H26O5/c1-10-5-6-14(21-4)17(19)8-13-11(7-16(10,17)2)12(9-20-3)15(18)22-13/h10,13-14,19H,5-9H2,1-4H3/t10-,13+,14+,16+,17-/m0/s1
InChIKeyVWYVYIKMLITSOS-OHGMZSHCSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (20155932)
ChEBI Ontology
Outgoing Relation(s)
1beta,13-dimethoxy-10alpha-hydroxyeremophil-7(11)-en-12,8beta-olide (CHEBI:202530) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(4aR,5S,8R,8aR,9aR)-8a-hydroxy-8-methoxy-3-(methoxymethyl)-4a,5-dimethyl-5,6,7,8,9,9a-hexahydro-4H-benzo[][1]benzouran-2-one
Manual XrefsDatabases
78436884ChemSpider