| SpectraBase Compound ID | C7BcXbfPBdn |
|---|---|
| InChI | InChI=1S/C22H30O5/c1-13-10-21-11-22(13,26)8-5-15(21)19(3)7-6-17(24)20(4,12-27-14(2)23)16(19)9-18(21)25/h10,15-16,26H,5-9,11-12H2,1-4H3/t15?,16?,19-,20+,21-,22-/m0/s1 |
| InChIKey | IGPLDSXYNGUBAC-IQQSNFQKSA-N |
| Mol Weight | 374.48 g/mol |
| Molecular Formula | C22H30O5 |
| Exact Mass | 374.209324 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GFXK9ynnPZM |
|---|---|
| Name | (ent)-18-Acetoxy-13-hydroxy-Kaur-15-ene-3,7-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O5 |
| InChI | InChI=1S/C22H30O5/c1-13-10-21-11-22(13,26)8-5-15(21)19(3)7-6-17(24)20(4,12-27-14(2)23)16(19)9-18(21)25/h10,15-16,26H,5-9,11-12H2,1-4H3/t15?,16?,19-,20+,21-,22-/m0/s1 |
| InChIKey | IGPLDSXYNGUBAC-IQQSNFQKSA-N |
| Molecular Weight | 374.477 g/mol |
| SMILES | O[C@@]12C[C@]3(C([C@@]4(CCC([C@@](C4CC3=O)(COC(=O)C)C)=O)C)CC2)C=C1C |
| SPLASH | splash10-01p9-2902000000-b55f35d63eaea0663e59 |
| Source of Spectrum | X2-53-444-16 |
| Wiley ID | 1603474 |