Bonducellpin C
Modify Date: 2025-08-20 22:18:12
Bonducellpin C structure
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Common Name | Bonducellpin C | ||
|---|---|---|---|---|
| CAS Number | 197781-84-3 | Molecular Weight | 420.496 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 515.8±50.0 °C at 760 mmHg | |
| Molecular Formula | C23H32O7 | Melting Point | 112-113℃ | |
| MSDS | N/A | Flash Point | 265.8±30.1 °C | |
| Name | methyl (1S,4aR,6S,6aR,7S,11aS,11bS)-1-acetoxy-4a,6-dihydroxy-4,4,11b-trimethyl-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydrophenanthro[3,2-b]furan-7-carboxylate |
|---|---|
| Synonym | More Synonyms |
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 515.8±50.0 °C at 760 mmHg |
| Melting Point | 112-113℃ |
| Molecular Formula | C23H32O7 |
| Molecular Weight | 420.496 |
| Flash Point | 265.8±30.1 °C |
| Exact Mass | 420.214813 |
| PSA | 106.20000 |
| LogP | 2.68 |
| Vapour Pressure | 0.0±1.4 mmHg at 25°C |
| Index of Refraction | 1.565 |
| InChIKey | SSVDXCWSMBMTOV-UHFFFAOYSA-N |
| SMILES | COC(=O)C1c2ccoc2CC2C1C(O)CC1(O)C(C)(C)CCC(OC(C)=O)C21C |
| Hazard Codes | Xi |
|---|
| Phenanthro[3,2-b]furan-7-carboxylic acid, 1-(acetyloxy)-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydro-4a,6-dihydroxy-4,4,11b-trimethyl-, methyl ester, (1S,4aR,6S,6aR,7S,11aS,11bS)- |
| Bonducellpin C |
| Methyl (1S,4aR,6S,6aR,7S,11aS,11bS)-1-acetoxy-4a,6-dihydroxy-4,4,11b-trimethyl-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydrophenanthro[3,2-b]furan-7-carboxylate |