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CHEBI:170105 - Yucalexin A16

ChEBI IDCHEBI:170105
ChEBI NameYucalexin A16
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O2
Net Charge0
Average Mass302.458
Monoisotopic Mass302.22458
SMILESCC1(O)CC23C=CC1CC2C1(C)CCC(=O)C(C)(C)C1CC3
InChIInChI=1S/C20H30O2/c1-17(2)14-6-10-20-9-5-13(19(4,22)12-20)11-15(20)18(14,3)8-7-16(17)21/h5,9,13-15,22H,6-8,10-12H2,1-4H3
InChIKeyAFZCVSRIUXFFJO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
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)
Yucalexin A16 (CHEBI:170105) has parent hydride atisane (CHEBI:36471)
Yucalexin A16 (CHEBI:170105) is a diterpenoid (CHEBI:23849)
IUPAC Name 
16-hydroxy-5,5,9,16-tetramethyltetracyclo[10.2.2.01,10.04,9]hexadec-13-en-6-one
Manual XrefsDatabases
HMDB0036775HMDB
35014244ChemSpider