| SpectraBase Compound ID | 9JrfCfclHKt |
|---|---|
| InChI | InChI=1S/C20H30O3/c1-6-18(4)11-13-14(21)10-15-17(2,3)8-7-9-20(15,23)19(13,5)16(22)12-18/h6,10,13,16,22-23H,1,7-9,11-12H2,2-5H3/t13-,16-,18+,19-,20-/m0/s1 |
| InChIKey | YWVNQQBAZQCNHR-WQNDOASUSA-N |
| Mol Weight | 318.46 g/mol |
| Molecular Formula | C20H30O3 |
| Exact Mass | 318.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JBJOLWpF4U4 |
|---|---|
| Name | Candidenodiol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O3 |
| InChI | InChI=1S/C20H30O3/c1-6-18(4)11-13-14(21)10-15-17(2,3)8-7-9-20(15,23)19(13,5)16(22)12-18/h6,10,13,16,22-23H,1,7-9,11-12H2,2-5H3/t13-,16-,18+,19-,20-/m0/s1 |
| InChIKey | YWVNQQBAZQCNHR-WQNDOASUSA-N |
| Molecular Weight | 318.457 g/mol |
| SMILES | O[C@]1(C[C@@](C[C@@]2([C@@]1([C@]1(C(=CC2=O)C(C)(C)CCC1)O)C)[H])(C=C)C)[H] |
| SPLASH | splash10-0uy0-0941000000-fb617f79de14e552a719 |
| Source of Spectrum | G4-60-481-3 |
| Synonyms | (4aS,4bS,5S,7R,8aR)-7-ethenyl-4a,5-dihydroxy-1,1,4b,7-tetramethyl-3,4,5,6,8,8a-hexahydro-2H-phenanthren-9-one (4aS,4bS,5S,7R,8aR)-7-ethenyl-1,1,4b,7-tetramethyl-4a,5-bis(oxidanyl)-3,4,5,6,8,8a-hexahydro-2H-phenanthren-9-one |
| Wiley ID | 1606697 |