| SpectraBase Compound ID | 6o6AIr3KhOE |
|---|---|
| InChI | InChI=1S/C23H32O6/c1-7-21(3)12-14(25)18-17(19(21)26)15(29-13(2)24)11-16-22(18,4)9-8-10-23(16,5)20(27)28-6/h7,14-16,25H,1,8-12H2,2-6H3/t14-,15-,16-,21+,22+,23-/m1/s1 |
| InChIKey | TTZVUQTVZWPIET-UZFQMMHMSA-N |
| Mol Weight | 404.5 g/mol |
| Molecular Formula | C23H32O6 |
| Exact Mass | 404.219889 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2WZkq4JWMrH |
|---|---|
| Name | Methyl 11.alpha.-hydroxy-7.alpha.-acetoxy-14-oxo-8,15-isopimaradien-18-oate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H32O6 |
| InChI | InChI=1S/C23H32O6/c1-7-21(3)12-14(25)18-17(19(21)26)15(29-13(2)24)11-16-22(18,4)9-8-10-23(16,5)20(27)28-6/h7,14-16,25H,1,8-12H2,2-6H3/t14-,15-,16-,21+,22+,23-/m1/s1 |
| InChIKey | TTZVUQTVZWPIET-UZFQMMHMSA-N |
| Molecular Weight | 404.503 g/mol |
| SMILES | O[C@]1(C2=C(C([C@](C1)(C=C)C)=O)[C@@](C[C@]1([C@](C(=O)OC)(CCC[C@]21C)C)[H])(OC(=O)C)[H])[H] |
| SPLASH | splash10-0699-2690000000-37873c258332aa199e7c |
| Source of Spectrum | G4-63-421-3 |
| Synonyms | (1R,4aS,5R,7R,9R,10aR)-9-acetyloxy-7-ethenyl-5-hydroxy-1,4a,7-trimethyl-8-oxo-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester Methyl (1R,4aS,5R,7R,9R,10aR)-9-acetyloxy-7-ethenyl-5-hydroxy-1,4a,7-trimethyl-8-oxo-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate Methyl (1R,4aS,5R,7R,9R,10aR)-9-acetoxy-5-hydroxy-1,4a,7-trimethyl-8-oxo-7-vinyl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate Methyl (1R,4aS,5R,7R,9R,10aR)-9-acetyloxy-7-ethenyl-1,4a,7-trimethyl-5-oxidanyl-8-oxidanylidene-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate |
| Wiley ID | 1608278 |