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CAS#: 53663-03-9 Product: Isobruceine B No suppilers available for the product. |
| Name | Isobruceine B |
|---|---|
| Synonyms | Picras-3-En-21-Oic Acid, 15-(Acetyloxy)-13,20-Epoxy-1,11,12-Trihydroxy-2,16-Dioxo-, Methyl Ester, (1Beta,11Beta,12Alpha,15Beta)-; Nsc 238181; C08770 |
| Molecular Structure |  |
| Molecular Formula | C23H28O11 |
| Molecular Weight | 480.47 |
| CAS Registry Number | 53663-03-9 |
| SMILES | [C@]123[C@H]4[C@@]5([C@@H](C[C@H]1OC(=O)[C@H](OC(=O)C)[C@H]2[C@](OC3)([C@@H](O)[C@@H]4O)C(OC)=O)C(=CC(=O)[C@H]5O)C)C |
| InChI | 1S/C23H28O11/c1-8-5-11(25)17(27)21(3)10(8)6-12-22-7-32-23(20(30)31-4,18(28)13(26)15(21)22)16(22)14(19(29)34-12)33-9(2)24/h5,10,12-18,26-28H,6-7H2,1-4H3/t10-,12+,13+,14+,15+,16+,17+,18-,21-,22+,23-/m0/s1 |
| InChIKey | WAYNIXHIORQRDI-RWLFMTGCSA-N |
| Density | 1.525g/cm3 (Cal.) |
|---|---|
| Boiling point | 696.064°C at 760 mmHg (Cal.) |
| Flash point | 239.302°C (Cal.) |
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