(-)-casbene (CHEBI:157595)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(−)-casbene

ChEBI ID	CHEBI:157595

ChEBI ASCII Name	(-)-casbene

Stars	This entity has been manually annotated by a third party.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C20H32

Net Charge

Average Mass

272.476

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+/t18-,19+/m0/s1

InChIKey

ZJMVJDFTNPZVMB-UNUVTCOTSA-N

SMILES

[C@]12([C@@](C=C(CCC=C(C)CCC=C(CC1)C)C)(C2(C)C)[H])[H]

Roles Classification
Biological Role(s):	antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via casbene )

ChEBI Ontology
Outgoing	(−)-casbene (CHEBI:157595) is a casbene (CHEBI:17695)

Incoming	4,5,8-trihydroxycasbene (CHEBI:157602) is a (−)-casbene (CHEBI:157595) 4,8-dihydroxycasbene (CHEBI:157601) is a (−)-casbene (CHEBI:157595) 4-hydroxy-8-oxocasbene (CHEBI:156579) is a (−)-casbene (CHEBI:157595) 4-hydroxycasbene (CHEBI:156578) 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

Synonym	Source
(−)-casbene	UniProt