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CHEBI:157595 - (−)-casbene

ChEBI IDCHEBI:157595
ChEBI Name(−)-casbene
Stars
ASCII Name(-)-casbene
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]12/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC[C@]1([H])C2(C)C
InChIInChI=1S/C20H32/c1-15-8-6-10-16(2)12-13-18-19(20(18,4)5)14-17(3)11-7-9-15/h9-10,14,18-19H,6-8,11-13H2,1-5H3/b15-9+,16-10+,17-14+/t18-,19+/m0/s1
InChIKeyZJMVJDFTNPZVMB-UNUVTCOTSA-N
Roles Classification
Biological Role:
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
ChEBI Ontology
Outgoing Relation(s)
(−)-casbene (CHEBI:157595) is a casbene (CHEBI:17695)
Incoming Relation(s)
4-hydroxy-8-oxocasbene (CHEBI:156579) is a (−)-casbene (CHEBI:157595)
4-hydroxycasbene (CHEBI:156578) is a (−)-casbene (CHEBI:157595)
4,5,8-trihydroxycasbene (CHEBI:157602) is a (−)-casbene (CHEBI:157595)
4,8-dihydroxycasbene (CHEBI:157601) is a (−)-casbene (CHEBI:157595)
5,8-dihydroxy-4-oxocasbene (CHEBI:157604) is a (−)-casbene (CHEBI:157595)
8-hydroxycasbene (CHEBI:157600) is a (−)-casbene (CHEBI:157595)
8-oxocasbene (CHEBI:156572) is a (−)-casbene (CHEBI:157595)
IUPAC Name 
(1S,2R,3E,7E,11E)-4,8,12,15,15-pentamethylbicyclo[12.1.0]pentadeca-3,7,11-triene
UniProt Name  Source
(−)-casbeneUniProt
Citations