nortrilobolide structure
|
Common Name | nortrilobolide | ||
|---|---|---|---|---|
| CAS Number | 136051-63-3 | Molecular Weight | 508.55800 | |
| Density | 1.29g/cm3 | Boiling Point | 596.5ºC at 760mmHg | |
| Molecular Formula | C26H36O10 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 190.6ºC | |
| Name | [(3S,3aR,6R,6aS,8R,9bS)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (Z)-2-methylbut-2-enoate |
|---|---|
| Synonym | More Synonyms |
| Density | 1.29g/cm3 |
|---|---|
| Boiling Point | 596.5ºC at 760mmHg |
| Molecular Formula | C26H36O10 |
| Molecular Weight | 508.55800 |
| Flash Point | 190.6ºC |
| Exact Mass | 508.23100 |
| PSA | 145.66000 |
| LogP | 2.04570 |
| Vapour Pressure | 1.02E-16mmHg at 25°C |
| Index of Refraction | 1.551 |
| InChIKey | WEJWYRUDUWBNIB-YQMCDBNQSA-N |
| SMILES | CC=C(C)C(=O)OC1CC2C(=C1C)C1OC(=O)C(C)(O)C1(O)C(OC(=O)CCC)CC2(C)OC(C)=O |
| Precursor 9 | |
|---|---|
| DownStream 0 | |
| 2-Butenoic acid,2-methyl-,6-(acetyloxy)-2,3,3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4-(1-oxobutoxy)azuleno(4,5-b)furan-8-yl ester,(3S-(3alpha,3abeta,4alpha,6beta,6abeta,8alpha(Z),9balpha)) |
| Nortrilobolide |