Norcaesalpinin E
Modify Date: 2025-08-27 11:23:46
Norcaesalpinin E structure
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Common Name | Norcaesalpinin E | ||
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| CAS Number | 854038-96-3 | Molecular Weight | 376.443 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 499.5±45.0 °C at 760 mmHg | |
| Molecular Formula | C21H28O6 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 255.9±28.7 °C | |
Use of Norcaesalpinin ENorcaesalpinin E is a natural cassane-type diterpene found in the seed kernels of Caesalpinia crista[1]. |
| Name | (1S,4aR,6S,6aS,11aS,11bS)-4a,6-dihydroxy-4,4,11b-trimethyl-7-oxo-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydrophenanthro[3,2-b]furan-1-yl acetate |
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| Synonym | More Synonyms |
| Description | Norcaesalpinin E is a natural cassane-type diterpene found in the seed kernels of Caesalpinia crista[1]. |
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| Related Catalog | |
| References |
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 499.5±45.0 °C at 760 mmHg |
| Molecular Formula | C21H28O6 |
| Molecular Weight | 376.443 |
| Flash Point | 255.9±28.7 °C |
| Exact Mass | 376.188599 |
| PSA | 96.97000 |
| LogP | 2.91 |
| Vapour Pressure | 0.0±1.3 mmHg at 25°C |
| Index of Refraction | 1.578 |
| InChIKey | IBALQPBIWZLHPR-UHFFFAOYSA-N |
| SMILES | CC(=O)OC1CCC(C)(C)C2(O)CC(O)C3C(=O)c4ccoc4CC3C12C |
| Hazard Codes | Xi |
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| (1S,4aR,6S,6aS,11aS,11bS)-4a,6-Dihydroxy-4,4,11b-trimethyl-7-oxo-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydrophenanthro[3,2-b]furan-1-yl acetate |
| Phenanthro[3,2-b]furan-7(2H)-one, 1-(acetyloxy)-1,3,4,4a,5,6,6a,11,11a,11b-decahydro-4a,6-dihydroxy-4,4,11b-trimethyl-, (1S,4aR,6S,6aS,11aS,11bS)- |