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CHEBI:142543 - isoelisabethatriene

ChEBI IDCHEBI:142543
ChEBI Nameisoelisabethatriene
Stars
DefinitionA carbobicylic compound that is 1,2,3,4,5,6-hexahydronaphthalene which is carrying a (6S)-2-methylhept-2-en-6-yl group at position 1 and methyl groups at positions 4R and 7.
Last Modified27 March 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]1([C@H](C)CCC=C(C)C)CC[C@@H](C)C2=C1C=C(C)CC2
InChIInChI=1S/C20H32/c1-14(2)7-6-8-16(4)19-12-10-17(5)18-11-9-15(3)13-20(18)19/h7,13,16-17,19H,6,8-12H2,1-5H3/t16-,17-,19+/m1/s1
InChIKeyUICVRWIQUTTXLD-LMMKCTJWSA-N
ChEBI Ontology
Outgoing Relation(s)
isoelisabethatriene (CHEBI:142543) is a carbobicyclic compound (CHEBI:36785)
isoelisabethatriene (CHEBI:142543) is a diterpene (CHEBI:35190)
isoelisabethatriene (CHEBI:142543) is a olefinic compound (CHEBI:78840)
IUPAC Name 
(1S,4R)-4,7-dimethyl-1-[(2R)-6-methylhept-5-en-2-yl]-1,2,3,4,5,6-hexahydronaphthalene
UniProt Name  Source
isoelisabethatrieneUniProt
Manual XrefsDatabases
CPD-21660MetaCyc
Citations