Carabrone
Modify Date: 2026-07-07 22:22:20
Carabrone structure
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Common Name | Carabrone | ||
|---|---|---|---|---|
| CAS Number | 1748-81-8 | Molecular Weight | 248.318 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 397.4±15.0 °C at 760 mmHg | |
| Molecular Formula | C15H20O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 176.5±20.4 °C | |
Use of CarabroneCarabrone is isolated from the fruits of Carpesium abrotanoides , is a well-known sesquiterpene and exhibits significant anti-bacterial and anti-tumor activities[1].Carabrone exhibits antifungal activities in vitro and in vivo against Botrytis cinerea, Colletotrichum lagenarium(EC50=7.10 μg/mL) and Erysiphe graminis[2]. |
| Name | (3aR,4aS,5S,5aR,6aR)-5a-methyl-3-methylidene-5-(3-oxobutyl)-3a,4,4a,5,6,6a-hexahydrocyclopropa[f][1]benzofuran-2-one |
|---|---|
| Synonym | More Synonyms |
| Description | Carabrone is isolated from the fruits of Carpesium abrotanoides , is a well-known sesquiterpene and exhibits significant anti-bacterial and anti-tumor activities[1].Carabrone exhibits antifungal activities in vitro and in vivo against Botrytis cinerea, Colletotrichum lagenarium(EC50=7.10 μg/mL) and Erysiphe graminis[2]. |
|---|---|
| Related Catalog | |
| Target |
EC50: 7.10 μg/mL (Colletotrichum lagenarium)[1] |
| References |
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 397.4±15.0 °C at 760 mmHg |
| Molecular Formula | C15H20O3 |
| Molecular Weight | 248.318 |
| Flash Point | 176.5±20.4 °C |
| Exact Mass | 248.141251 |
| PSA | 43.37000 |
| LogP | 1.40 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.525 |
| InChIKey | AGIQIKMGJVLKMA-NLRWUALESA-N |
| SMILES | C=C1C(=O)OC2CC3(C)C(CCC(C)=O)C3CC12 |
| Hazard Codes | Xi |
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| Carabron |
| 5a-Methyl-3-methylene-5-(3-oxobutyl)octahydro-2H-cyclopropa[f][1]benzofuran-2-one |
| Carabrone |
| (3aR,4aS,5S,5aR,6aR)-5a-Methyl-3-methylene-5-(3-oxobutyl)octahydro-2H-cyclopropa[f][1]benzofuran-2-one |