
CAS Number31581-02-9
SynonymsCinnamyl 3b-Hydroxy-11-oxoolean-12-en-30-oate Acetate; Cinoxolonum [INN-Latin]; Cinnamyl 3β-hydroxy-11-oxoolean-12-en-30-oate acetate; EINECS 250-715-9; Cinoxolonum; Cinamyl 3beta-acetoxy-11-oxo-12-oleanen-30-oat; Cinoxolona; Cinoxolona [INN-Spanish]; (E)-2-Phenylvinyl (3β)-3-acetoxy-11-oxoolean-12-en-30-oate; 2-Phenylvinyl (3b)-3-(Acetyloxy)-11-oxoolean-12-en-30-oate; Cinoxolone
Molecular FormulaC41H56O5
Molecular Weight614.854
Density1.1±0.1 g/cm3
Boiling Point675.4±55.0 °C at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 31581-02-9 |
| Catalog No. | 2A-1183084 |
| Chinese Name | 桂克索龙 |
| Synonyms | Cinnamyl 3b-Hydroxy-11-oxoolean-12-en-30-oate Acetate; Cinoxolonum [INN-Latin]; Cinnamyl 3β-hydroxy-11-oxoolean-12-en-30-oate acetate; EINECS 250-715-9; Cinoxolonum; Cinamyl 3beta-acetoxy-11-oxo-12-oleanen-30-oat; Cinoxolona; Cinoxolona [INN-Spanish]; (E)-2-Phenylvinyl (3β)-3-acetoxy-11-oxoolean-12-en-30-oate; 2-Phenylvinyl (3b)-3-(Acetyloxy)-11-oxoolean-12-en-30-oate; Cinoxolone |
| Molecular Formula | C41H56O5 |
| Molecular Weight | 614.854 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 675.4±55.0 °C at 760 mmHg |
| PubChem ID | 135030349 |
| SMILES | CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)[C@]4(C)CC[C@@]5(C)CC[C@@](C)(C[C@H]5C4=CC(=O)[C@]23C)C(=O)O\C=C\c6ccccc6)C1(C)C |
| InChI | InChI=1S/C41H56O5/c1-27(42)46-33-16-18-39(7)31(35(33,2)3)15-19-40(8)38(6)23-22-36(4)20-21-37(5,26-30(36)29(38)25-32(43)41(39,40)9)34(44)45-24-17-28-13-11-10-12-14-28/h10-14,17,24-25,30-31,33H,15-16,18-23,26H2,1-9H3/b24-17+/t30-,31-,33-,36+,37-,38+,39-,40-,41+/m0/s1 |
| InChI Key | InChIKey=LLHKWQVCQJLCRR-FUMGLWPYSA-N |
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