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CHEBI:137528 - tsukubadiene

ChEBI IDCHEBI:137528
ChEBI Nametsukubadiene
Stars
DefinitionA tricyclic diterpene with formula C20H32 which is produced by a diterpene cyclase gene expressed in an engineered Streptomyces host.
Last Modified3 August 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]12CC[C@H](C)/C1=C/[C@@]1(C)CCC(C)(C)[C@]1([H])C/C=C(/C)C2
InChIInChI=1S/C20H32/c1-14-6-9-18-19(3,4)10-11-20(18,5)13-17-15(2)7-8-16(17)12-14/h6,13,15-16,18H,7-12H2,1-5H3/b14-6-,17-13-/t15-,16-,18-,20+/m0/s1
InChIKeyJZGOFJIAHJJJDK-ICZJPRMTSA-N
ChEBI Ontology
Outgoing Relation(s)
tsukubadiene (CHEBI:137528) is a carbotricyclic compound (CHEBI:38032)
tsukubadiene (CHEBI:137528) is a diterpene (CHEBI:35190)
tsukubadiene (CHEBI:137528) is a polycyclic olefin (CHEBI:35714)
IUPAC Name 
(1S,3aS,7aS,10aR)-1,5,8,8,10a-pentamethyl-2,3,3a,4,7,7a,8,9,10,10a-decahydro-1H-dicyclopenta[a,d][9]annulene
UniProt Name  Source
tsukubadieneUniProt
Manual XrefsDatabases
CPD-20078MetaCyc
Registry NumbersSources
Reaxys:30940896Reaxys
Citations