| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 473-08-5 |
| FDA UNII: | ZL24SG1C2D |
| Category: | natural substances and extractives |
| IUPAC Name: | alpha-cyperone |
| InChI : | InChI=1/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15+/m1/s1 |
| Std.InChI: | InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15+/m1/s1 |
| InChIKey : | KUFXJZXMWHNCEH-DOMZBBRYBH |
| Std.InChIKey: | KUFXJZXMWHNCEH-DOMZBBRYSA-N |
| SMILES : | CC1=C2C[C@@H](CC[C@]2(CCC1=O)C)C(=C)C |
| MDL: | MFCD09839027 |
| Molar Refractivity : | 66.50 ± 0.4 cm3 (est) |
| Parachor : | 536.8 ± 6.0 cm3 (est) |
| Index of Refraction : | 1.503 ± 0.03 (est) |
| Surface Tension : | 32.5 ± 5.0 dyne/cm (est) |
| Density : | 0.97 ± 0.1 g/cm3 (est) |
| Polarizability : | 26.36 ± 0.5 10-24cm3 (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 320.40 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 289.00 °F. TCC ( 142.80 °C. ) (est) |
| logP (o/w): | 4.220 (est) |
| Soluble in: | |
| water, 1.84 mg/L @ 25 °C (est) | |
| None found |
| Alfa Biotechnology |
| For experimental / research use only. |
| a-Cyperone 98% |
| BOC Sciences |
| For experimental / research use only. |
| alpha-Cyperone >98% Odor: characteristic Use: a-Cyperone, that is isolated from the rhizomes of Cyperus rotundus L, significantly inhibited PGE2 production by suppressing the LPS-induced expression of inducible COX-2 at both the mRNA and the protein levels. In contrast, a-cyperone had little effect |
| Carbosynth |
| For experimental / research use only. |
| alpha-Cyperone |
| Coompo |
| For experimental / research use only. |
| alpha-Cyperone from Plants ≥98% Odor: characteristic Use: a-Cyperone significantly inhibited PGE2 production by suppressing the LPS-induced expression of inducible COX-2 at both the mRNA and the protein levels. In contrast, a-cyperone had little effect on NO production and iNOS expression. Additionally, a-cyperone downregulated the production and mRNA expression of the inflammatory cytokine IL-6. Moreover, treatment with a-cyperone suppressed the transcriptional activity of NF?B and the nuclear translocation of the p65 NF?B subunit in LPS-induced RAW 264.7 cells. |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| natural substances and extractives | |||
| Recommendation for alpha-cyperone usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for alpha-cyperone flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :6452086 |
| National Institute of Allergy and Infectious Diseases:Data |
| (4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one |
| Chemidplus:0000473085 |
| (4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 6452086 |
| Pubchem (sid): | 135251766 |
| Pherobase: | View |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| CHEMBL: | View |
| KEGG (GenomeNet): | C17090 |
| HMDB (The Human Metabolome Database): | HMDB37061 |
| FooDB: | FDB016044 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| None Found |
| None Found |
| a- | cyperone |
| (4aS,7R)-1,4a- | dimethyl-7-(prop-1-en-2-yl)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one |
| (4aS,7R)-1,4a- | dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one |
| eudesma-4,11-dien-3-one | |
| (4aS-cis)-4,4a,5,6,7,8- | hexahydro-1,4a-dimethyl-7-(1-methyl ethenyl)-2(3H)-naphthalenone |
| (4aS-cis)-4,4a,5,6,7,8- | hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone |
| 2(3H)- | naphthalenone, 4,4a,5,6,7,8-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, (4aS-cis)- |
| 2(3H)- | naphthalenone, 4,4a,5,6,7,8-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, (4aS,7R)- |
| (4aS,7R)-7-iso | propenyl-1,4a-dimethyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone |
