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CHEBI:170128 - ent-16-Kauren-19-ol acetate

ChEBI IDCHEBI:170128
ChEBI Nameent-16-Kauren-19-ol acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O2
Net Charge0
Average Mass330.512
Monoisotopic Mass330.25588
SMILESC=C1CC23CCC4C(C)(COC(C)=O)CCCC4(C)C2CCC1C3
InChIInChI=1S/C22H34O2/c1-15-12-22-11-8-18-20(3,14-24-16(2)23)9-5-10-21(18,4)19(22)7-6-17(15)13-22/h17-19H,1,5-14H2,2-4H3
InChIKeyFNLMCLYZRZJKQZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Homo sapiens (ncbitaxon:9606)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
ChEBI Ontology
Outgoing Relation(s)
ent-16-Kauren-19-ol acetate (CHEBI:170128) is a kaurane diterpenoid (CHEBI:53666)
IUPAC Name 
(5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)methyl acetate
Manual XrefsDatabases
468201ChemSpider
HMDB0035024HMDB