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CHEBI:174807 - 11,12-Dimethoxy-8,11,13-abietatrien-20,7-olide

Default Structure
ChEBI IDCHEBI:174807
ChEBI Name11,12-Dimethoxy-8,11,13-abietatrien-20,7-olide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O4
Net Charge0
Average Mass358.478
Monoisotopic Mass358.21441
SMILESCOc1c(C(C)C)cc2c(c1OC)C13CCCC(C)(C)C1CC2OC3=O
InChIInChI=1S/C22H30O4/c1-12(2)13-10-14-15-11-16-21(3,4)8-7-9-22(16,20(23)26-15)17(14)19(25-6)18(13)24-5/h10,12,15-16H,7-9,11H2,1-6H3
InChIKeyBMUVJFGCCPHXOJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
11,12-Dimethoxy-8,11,13-abietatrien-20,7-olide (CHEBI:174807) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
3,4-dimethoxy-11,11-dimethyl-5-propan-2-yl-16-oxatetracyclo[6.6.2.01,10.02,7]hexadeca-2,4,6-trien-15-one
Manual XrefsDatabases
35014033ChemSpider
HMDB0035856HMDB