Alpha-caryophyllene
Alpha-caryophyllene structure
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Common Name | Alpha-caryophyllene | ||
|---|---|---|---|---|
| CAS Number | 6753-98-6 | Molecular Weight | 204.35100 | |
| Density | 0.889 g/mL at 20 °C(lit.) | Boiling Point | 166-168 °C(lit.) | |
| Molecular Formula | C15H24 | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 90°C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of Alpha-caryophylleneα-Humulene is a main constituent of Tanacetum vulgare L. (Asteraceae) essential oil with anti-inflammation (IC50=15±2 µg/mL). α-Humulene inhibits COX-2 and iNOS expression[1]. |
| Name | (1E,4E,8E)-α-humulene |
|---|---|
| Synonym | More Synonyms |
| Description | α-Humulene is a main constituent of Tanacetum vulgare L. (Asteraceae) essential oil with anti-inflammation (IC50=15±2 µg/mL). α-Humulene inhibits COX-2 and iNOS expression[1]. |
|---|---|
| Related Catalog | |
| Target |
COX-2 iNOS |
| In Vitro | The cytotoxicity of α-Humulene against human lung carcinoma A549, colon adenocarcinoma DLD-1, skin fibroblasts WS1 cell lines is 28±1, 43±3, and 24±3 µg/mL, respetctively[1]. |
| References |
| Density | 0.889 g/mL at 20 °C(lit.) |
|---|---|
| Boiling Point | 166-168 °C(lit.) |
| Molecular Formula | C15H24 |
| Molecular Weight | 204.35100 |
| Flash Point | 90°C |
| Exact Mass | 204.18800 |
| LogP | 5.03540 |
| Index of Refraction | n20/D 1.503(lit.) |
| InChIKey | FAMPSKZZVDUYOS-KXWHQPPKSA-N |
| SMILES | CC1=CCCC(C)=CCC(C)(C)C=CC1 |
| Storage condition | 2-8°C |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
|
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi |
| Risk Phrases | 36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | NA 1993 / PGIII |
| WGK Germany | 3 |
| RTECS | GZ4817500 |
| HS Code | 2902199090 |
| HS Code | 2902199090 |
|---|---|
| Summary | 2902199090 other cyclanes, cyclenes and cyclotherpenes。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:2.0%。General tariff:30.0% |
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Analysis of the essential oil of Amsonia illustris.
Nat. Prod. Commun. 6(2) , 235-6, (2011) The root and leaf essential oils, present in trace amounts in Amsonia illustris Woods. (Apocynaceae), were isolated by steam distillation and their chemical constituents identified by GC-FID and GC-MS... |
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Rational engineering of plasticity residues of sesquiterpene synthases from Artemisia annua: product specificity and catalytic efficiency.
Biochem. J. 451(3) , 417-26, (2013) Most TPSs (terpene synthases) contain plasticity residues that are responsible for diversified terpene products and functional evolution, which provide a potential for improving catalytic efficiency. ... |
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The gas-phase ozonolysis of α-humulene.
Phys. Chem. Chem. Phys. 13(23) , 10970-1001, (2011) α-Humulene contains three double bonds (DB), and after ozonolysis of the first DB the first-generation products are still reactive towards O(3) and produce second- and third-generation products. The p... |
| (1E,4E,8E)-alpha-humulene |
| EINECS 229-816-7 |
| α-Caryophyllene |
| MFCD00042689 |
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- Shanghai Nianxing Industrial Co., Ltd
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- China
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