β-Caryophyllene
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Beta-caryophyllene
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Data
InChI: InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3
Synonyms: Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, [1R-(1R*,4E,9S*)]-, DSSTox_RID_77517, Caryophyllene, (E), Caryophyllene, (-)- -caryophyllene, trans-Caryophyllene, (-)-(E)-Caryophyllene, UNII-K4H93P747O component NPNUFJAVOOONJE-GFUGXAQUSA-N, trans-(1R,9S)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene, (1R,4E,9S)-4,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-ene, (1S,9R)-6,10,10-trimethyl-2-methylenebicyclo[7.2.0]undec-5-ene, V0915, Caryophyllene B, beta-Caryophyllene, (-), NCGC00255159-01, L-Caryophyllene, g-Caryophyllene, W-109317, Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (E)-(1R,9S)-(-)-, CHEMBL445740, beta-trans-Caryophyllene, (-)-trans-Caryophyllene, analytical standard, (-)-trans-Caryophyllene, >=98.5% (sum of enantiomers, GC), beta-trans-caryophyllene, HY-N1415, trans-(1R,9S)-8-Methylene-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene, beta-(e)-caryophyllene, Tincturoid, Bicyclo[7.2.0]undec-4-ene, 8-methylene-4,11,11-trimethyl-, (E)-(1R,9S)-(-)-, (1R,4E,9S)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene, (-)-I(2)-caryophyllene, ZINC8234282, (-)-beta-caryophyllene, Tox21_301497, UNII-BHW853AU9H, (E)-beta-caryophylene, 87-44-5, NSC 11906, (E)-Caryophyllene, CS-0016839, E-beta-caryophyllene, 8-Methylene-4,11,11-(trimethyl)bicyclo[7.2.0]undec-4-ene, s6058, beta-Caryophyllen, trans-.beta.-Caryophyllene, beta-caryophillene, DSSTox_CID_4739, E-.beta.-caryophyllene, C09629, CAS-87-44-5,β-Caryophyllene, Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, [1R- (1R*,4E,9S*)]-, (1R,9S,E)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene, 8-Methylene-4,11,11-(trimethyl)bicyclo(7.2.0)undec-4-ene, (1R,4E,9S)-, BHW853AU9H,BETA-CARYOPHYLLENE, (-)-Caryophyllene, DTXSID8024739, Q421614, (E)-beta-caryophyllene, MFCD00075925, Beta-Caryophylene, AKOS024283988, beta-cariofillene, NCGC00142620-01, (-)-trans-Caryophyllene, beta-Caryophyllene, DSSTox_GSID_24739, LMPR0103120001, Bicyclo(7.2.0)undec-4-ene, 8-methylene-4,11,11-trimethyl-, (E)-(1R,9S)-(-)-, BDBM50529607, (1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene, beta-Caryophyllene, >=80%, FCC, FG, trans-beta-caryophyllene, CHEBI:10357, b-caryophyllene, beta-(E)-Caryophyllene, NSC11906, ST072181
Estimated data
Solubility: -5.799 (log(S) in mol/L prediction using SolTranNet)
Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)
Addictivity Prediction: 59.4% (prediction based on www.mdpi.com)
