CHEBI:17695 - casbene

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ChEBI Name casbene
ChEBI ID CHEBI:17695
Definition A diterpene comprising bicyclo[12.1.0]pentadeca-2,6,10-triene having three methyl substituents located at the 3-, 7- and 11-positions as well as gem-dimethyl groups at the 15-position.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3444, CHEBI:13949, CHEBI:23049
Supplier Information
Download Molfile XML SDF
Formula C20H32
Net Charge 0
Average Mass 272.46808
Monoisotopic Mass 272.25040
InChI InChI=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+
InChIKey ZJMVJDFTNPZVMB-QOCMWZQCSA-N
SMILES C\C1=C/CC\C(C)=C\C2C(CC\C(C)=C\CC1)C2(C)C
Roles Classification
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing casbene (CHEBI:17695) has parent hydride casbane (CHEBI:36768)
casbene (CHEBI:17695) has role antifungal agent (CHEBI:35718)
casbene (CHEBI:17695) is a diterpene (CHEBI:35190)
Incoming (−)-casbene (CHEBI:157595) is a casbene (CHEBI:17695)
IUPAC Name
(2E,6E,10E)-3,7,11,15,15-pentamethylbicyclo[12.1.0]pentadeca-2,6,10-triene
Synonyms Sources
Casbene KEGG COMPOUND
casbene UniProt
Manual Xrefs Databases
C00000864 KNApSAcK
C01414 KEGG COMPOUND
LMPR0104290001 LIPID MAPS
View more database links
Registry Number Type Source
5269179 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
16660566 PubMed citation Europe PMC
16662367 PubMed citation Europe PMC
16664817 PubMed citation Europe PMC
Last Modified
09 April 2015