Compound Summary
BETA-CARYOPHYLLENE
Compound Information
BETA-CARYOPHYLLENE
Compound Name: | BETA-CARYOPHYLLENE |
Compound CID: | 5281515 |
Synonyms: | BETA-CARYOPHYLLENE Caryophyllene (-)-trans-Caryophyllene 87-44-5 L-Caryophyllene More... |
Iupac Name: | (1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene |
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/b11-6+/t13-,14-/m1/s1 |
InChIKey: | NPNUFJAVOOONJE-GFUGXAQUSA-N |
Canonical Smiles: | CC1=CCCC(=C)C2CC(C2CC1)(C)C |
Isomeric Smiles: | C/C/1=C\CCC(=C)[C@H]2CC([C@@H]2CC1)(C)C |
Molecular Weight: | 204.35 |
Molecular Formula: | C15H24 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
BETA-CARYOPHYLLENE
Molecular Weight: | 204.35 |
Molecular Formula: | C15H24 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 0 |
Rotatable Bond Count: | 0 |
Heavy Atom Count: | 15 |
Complexity: | 293 |
Synonyms
BETA-CARYOPHYLLENE
| BETA-CARYOPHYLLENE | BETA-CARYOPHYLLENE |
|---|---|
BETA-CARYOPHYLLENE |
Caryophyllene |
(-)-trans-Caryophyllene |
87-44-5 |
L-Caryophyllene |
(-)-beta-caryophyllene |
b-caryophyllene |
trans-Caryophyllene |
trans-beta-caryophyllene |
(E)-Caryophyllene |
(E)-beta-caryophyllene |
Beta-Caryophylene |
(-)-Caryophyllene |
.beta.-Caryophyllen |
.beta.-Caryophyllene |
CHEBI:10357 |
(E)-beta-caryophylene |
(-)-(E)-Caryophyllene |
.beta.-(E)-Caryophyllene |
beta-Caryophyllen |
(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo7.2.0undec-4-ene |
MFCD00075925 |
UNII-BHW853AU9H |
g-Caryophyllene |
FEMA No. 2252 |
(1S,9R)-6,10,10-trimethyl-2-methylenebicyclo7.2.0undec-5-ene |
NSC 11906 |
E-.beta.-caryophyllene |
BHW853AU9H |
.beta.-Caryophyllene, (-) |
Tincturoid |
NSC11906 |
Caryophyllene B |
beta-cariofillene |
NSC-11906 |
(1R,4E,9S)-4,11,11-trimethyl-8-methylene-bicyclo7.2.0undec-4-ene |
beta-caryophillene |
Bicyclo(7.2.0)undec-4-ene, 8-methylene-4,11,11-trimethyl-, (E)-(1R,9S)-(-)- |
Bicyclo7.2.0undec-4-ene, 8-methylene-4,11,11-trimethyl-, (E)-(1R,9S)-(-)- |
Bicyclo7.2.0undec-4-ene, 4,11,11-trimethyl-8-methylene-, 1R-(1R*,4E,9S*)- |
E-beta-caryophyllene |
Caryophyllene, (E) |
(?)-b-caryophyllene |
beta-(e)-caryophyllene |
beta-trans-caryophyllene |
(?)-trans-Caryophyllene |
DSSTox_CID_4739 |
.beta.-trans-Caryophyllene |
trans-.beta.-Caryophyllene |
(-)-I(2)-caryophyllene |
DSSTox_RID_77517 |
DSSTox_GSID_24739 |
8-Methylene-4,11,11-(trimethyl)bicyclo7.2.0undec-4-ene |
CHEMBL445740 |
DTXSID8024739 |
HY-N1415 |
ZINC8234282 |
Tox21_301497 |
BDBM50529607 |
s6058 |
(1R,4E,9S)-4,11,11-trimethyl-8-methylenebicyclo7.2.0undec-4-ene |
AKOS024283988 |
trans-(1R,9S)-8-Methylene-4,11,11-trimethylbicyclo7.2.0undec-4-ene |
LMPR0103120001 |
beta-Caryophyllene, >=80%, FCC, FG |
CAS-87-44-5 |
NCGC00142620-01 |
NCGC00255159-01 |
ST072181 |
(-)-trans-Caryophyllene, analytical standard |
CS-0016839 |
V0915 |
C09629 |
beta-Caryophyllene 2000 microg/mL in Acetonitrile |
Q421614 |
W-109317 |
UNII-K4H93P747O component NPNUFJAVOOONJE-GFUGXAQUSA-N |
(-)-trans-Caryophyllene, >=98.5% (sum of enantiomers, GC) |
trans-(1R,9S)-4,11,11-trimethyl-8-methylenebicyclo7.2.0undec-4-ene |
8-Methylene-4,11,11-(trimethyl)bicyclo(7.2.0)undec-4-ene, (1R,4E,9S)- |
Bicyclo7.2.0undec-4-ene, 4,11,11-trimethyl-8-methylene-, (E)-(1R,9S)-(-)- |
Bicyclo7.2.0undec-4-ene, 4,11,11-trimethyl-8-methylene-, 1R- (1R*,4E,9S*)- |
Experimental Data
BETA-CARYOPHYLLENE
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 50.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 25.000000000000000 | umol/L | 17.470000000000000 | 19.910000000000000 | 12.200000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 16.990000000000000 | 19.100000000000000 | 12.410000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 17.470000000000000 | 20.350000000000000 | 16.480000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 16.990000000000000 | 20.820000000000000 | 22.540000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 17.880000000000000 | 21.840000000000000 | 22.700000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 25.000000000000000 | umol/L | 16.990000000000000 | 18.970000000000000 | 11.120000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 17.470000000000000 | 21.200000000000000 | 21.350000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 25.000000000000000 | umol/L | 17.880000000000000 | 19.700000000000000 | 10.170000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 17.880000000000000 | 20.690000000000000 | 15.700000000000000 | S | N2 | 24835194 | Active | ||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 22.200000000000000 | S | N2 | 33683565 | Active | ||||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 14.900000000000000 | S | N2 | 33683565 | Active | ||||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 7.200000000000000 | S | N2 | 33683565 | Active | ||||||
| Caenorhabditis elegans | 25.000000000000000 | umol/L | 11.200000000000000 | S | N2 | 33683565 | Active | ||||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 12.200000000000000 | S | N2 | 33683565 | Active |
Experimental Data Visualization
BETA-CARYOPHYLLENE
Statistics Data
BETA-CARYOPHYLLENE
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 22.700000000000000 | 2 | 15 |
Statistics Data Visualization
BETA-CARYOPHYLLENE
