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Merck
CN

C9653

(−)-trans-Caryophyllene

Synonym(s):

β-Caryophyllene, trans-(1R,9S)-8-Methylene-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene

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About This Item

Empirical Formula (Hill Notation):
C15H24
CAS Number:
87-44-5
Molecular Weight:
204.35
EC Number:
201-746-1
UNSPSC Code:
12352200
PubChem Substance ID:
24893184
Beilstein/REAXYS Number:
2044564
MDL number:
MFCD00075925

Key Documents

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InChI key

NPNUFJAVOOONJE-GFUGXAQUSA-N

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

SMILES string

[H][C@@]12CC\C(C)=C\CCC(=C)[C@H]1CC2(C)C

bp

262-264 °C (lit.)

density

0.902 g/mL at 20 °C (lit.)

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pictograms

Health hazardExclamation mark
GHS08,GHS07

signalword

Danger

hcodes

H304,H317

Hazard Classifications

Asp. Tox. 1 - Skin Sens. 1B

Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

221.9 °F - closed cup

flash_point_c

105.5 °C - closed cup

ppe

Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
058K1551
057K1286
076K2618
094K2642
045K2620

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Natural product communications, 8(3), 401-402 (2013-05-18)
The essential oil composition from the aerial parts of Baccharoides lilacina (Dalzell & A. Gibson) M. R. Almeida was analyzed by gas chromatography (GC) and gas chromatography/mass spectrometry (GC/MS). A total of 41 compounds have been identified, representing 97.4% of
Pablinny Moreira Galdino et al.
Progress in neuro-psychopharmacology & biological psychiatry, 38(2), 276-284 (2012-05-01)
Spiranthera odoratissima A. St. Hil. (manacá) is used in folk medicine to treat renal and hepatic diseases, stomachache, headaches and rheumatism. A central nervous system (CNS) depressant effect of the hexane fraction from the ethanolic extract of this plant has
Louis M T Bradbury et al.
Proceedings of the National Academy of Sciences of the United States of America, 109(27), E1888-E1897 (2012-06-19)
In photosynthetic organisms, carotenoids serve essential roles in photosynthesis and photoprotection. A previous report designated CruP as a secondary lycopene cyclase involved in carotenoid biosynthesis [Maresca J, et al. (2007) Proc Natl Acad Sci USA 104:11784-11789]. However, we found that
In-Young Choi et al.
The American journal of pathology, 182(3), 928-939 (2013-02-19)
The type 2 cannabinoid receptor (CB2R) was recently shown to mediate neuroprotection in ischemic injury. However, the role of CB2Rs in the central nervous system, especially neuronal and glial CB2Rs in the cortex, remains unclear. We, therefore, investigated anti-ischemic mechanisms
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