| SpectraBase Compound ID | 9N7HcVBlcQb |
|---|---|
| InChI | InChI=1S/C25H38O5/c1-22(2)8-6-9-23(3)14(22)7-10-24(4)15(23)12-17(27)25(5)16(24)11-13(26)18-19(25)21(29)30-20(18)28/h13-17,21,26-27,29H,6-12H2,1-5H3/t13-,14+,15-,16+,17-,21-,23+,24-,25-/m1/s1 |
| InChIKey | GAQSWPYYPSDAAV-ZOBQAXMWSA-N |
| Mol Weight | 418.6 g/mol |
| Molecular Formula | C25H38O5 |
| Exact Mass | 418.271924 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GaufMzfp8EO |
|---|---|
| Name | Hyrtiolide |
| Alternate Name(s) | (1R,4R,5aS,5bR,7aS,11aS,11bR,13R,13aS)-1,4,13-trihydroxy-5b,8,8,11a,13a-pentamethyl-4,5,5a,6,7,7a,9,10,11,11b,12,13-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-3-one (1R,4R,5aS,5bR,7aS,11aS,11bR,13R,13aS)-1,4,13-trihydroxy-5b,8,8,11a,13a-pentamethyl-4,5,5a,6,7,7a,9,10,11,11b,12,13-dodecahydro-1H-phenanthro[2,1-e]isobenzofuran-3-one (1R,4R,5aS,5bR,7aS,11aS,11bR,13R,13aS)-5b,8,8,11a,13a-pentamethyl-1,4,13-tris(oxidanyl)-4,5,5a,6,7,7a,9,10,11,11b,12,13-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H38O5 |
| InChI | InChI=1S/C25H38O5/c1-22(2)8-6-9-23(3)14(22)7-10-24(4)15(23)12-17(27)25(5)16(24)11-13(26)18-19(25)21(29)30-20(18)28/h13-17,21,26-27,29H,6-12H2,1-5H3/t13-,14+,15-,16+,17-,21-,23+,24-,25-/m1/s1 |
| InChIKey | GAQSWPYYPSDAAV-ZOBQAXMWSA-N |
| Molecular Weight | 418.574 g/mol |
| SMILES | O[C@]1(C2=C([C@@](C[C@@]3([C@@]2([C@@](C[C@@]2([C@@]4([C@@](CC[C@@]32C)(C(CCC4)(C)C)[H])C)[H])(O)[H])C)[H])(O)[H])C(O1)=O)[H] |
| SPLASH | splash10-0udi-0001900000-db72a10b78dcb2eed066 |
| Source of Spectrum | G4-63-1371-1 |
| Wiley ID | 1608635 |