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CHEBI:170103 - (ent-15beta,16beta)-15,16-Epoxy-3-kauranone

ChEBI IDCHEBI:170103
ChEBI Name(ent-15beta,16beta)-15,16-Epoxy-3-kauranone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O2
Net Charge0
Average Mass302.458
Monoisotopic Mass302.22458
SMILESCC1(C)C(=O)CCC2(C)C1CCC13CC(CCC21)C1(C)OC31
InChIInChI=1S/C20H30O2/c1-17(2)13-7-10-20-11-12(19(4)16(20)22-19)5-6-14(20)18(13,3)9-8-15(17)21/h12-14,16H,5-11H2,1-4H3
InChIKeySVKMTDSTFGJBCS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
(ent-15beta,16beta)-15,16-Epoxy-3-kauranone (CHEBI:170103) is a kaurane diterpenoid (CHEBI:53666)
IUPAC Name 
5,5,9,14-tetramethyl-15-oxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecan-6-one
Manual XrefsDatabases
HMDB0038687HMDB
35014635ChemSpider