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CHEBI:174324 - (1(10)E,4E,6a,9b)-9-(2-Methylpropanoyloxy)-1(10),4,11(13)-germacratrien-12,6-olide

ChEBI IDCHEBI:174324
ChEBI Name(1(10)E,4E,6a,9b)-9-(2-Methylpropanoyloxy)-1(10),4,11(13)-germacratrien-12,6-olide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O4
Net Charge0
Average Mass318.413
Monoisotopic Mass318.18311
SMILESC=C1C(=O)OC2/C=C(\C)CC/C=C(\C)C(OC(=O)C(C)C)CC12
InChIInChI=1S/C19H26O4/c1-11(2)18(20)22-16-10-15-14(5)19(21)23-17(15)9-12(3)7-6-8-13(16)4/h8-9,11,15-17H,5-7,10H2,1-4H3/b12-9+,13-8+
InChIKeyXXAILDIUKGAZIM-GHEQENTPSA-N
ChEBI Ontology
Outgoing Relation(s)
(1(10)E,4E,6a,9b)-9-(2-Methylpropanoyloxy)-1(10),4,11(13)-germacratrien-12,6-olide (CHEBI:174324) is a germacranolide (CHEBI:73011)
IUPAC Name 
[(6E,10E)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]uran-5-yl] 2-methylpropanoate
Manual XrefsDatabases
HMDB0031373HMDB
35013352ChemSpider