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CHEBI:167426 - Kaurene

ChEBI IDCHEBI:167426
ChEBI NameKaurene
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]12CC[C@]3([H])C(CC[C@]4([H])C(C)(C)CC=C[C@]43C)(C[C@@H]1C)C2
InChIInChI=1S/C20H32/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h5,10,14-17H,6-9,11-13H2,1-4H3/t14-,15-,16+,17-,19+,20?/m0/s1
InChIKeyIODSADAHQKFXES-CCJFMQDPSA-N
ChEBI Ontology
Outgoing Relation(s)
Kaurene (CHEBI:167426) is a kaurane diterpenoid (CHEBI:53666)
IUPAC Name 
(4R,9R,10R,13S,14S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadec-7-ene
Manual XrefsDatabases
2298511ChemSpider
Registry NumbersSources
CAS:34424-57-2ChemIDplus