| SpectraBase Compound ID | 2KwQpp8K13N |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-19(8-7-9-20(2)25(32)33)21-12-14-28(6)23-11-10-22-26(3,4)24(31)13-15-29(22)18-30(23,29)17-16-27(21,28)5/h9,19,21-23H,7-8,10-18H2,1-6H3,(H,32,33)/b20-9-/t19-,21?,22+,23+,27-,28+,29-,30+/m1/s1 |
| InChIKey | MZPNVEOVZSHYMZ-UMJPLONPSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EQzamguQN3D |
|---|---|
| Name | Schizandronic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-19(8-7-9-20(2)25(32)33)21-12-14-28(6)23-11-10-22-26(3,4)24(31)13-15-29(22)18-30(23,29)17-16-27(21,28)5/h9,19,21-23H,7-8,10-18H2,1-6H3,(H,32,33)/b20-9-/t19-,21?,22+,23+,27-,28+,29-,30+/m1/s1 |
| InChIKey | MZPNVEOVZSHYMZ-UMJPLONPSA-N |
| Molecular Weight | 454.695 g/mol |
| SMILES | OC(\C(=C/CC[C@](C1[C@]2(CC[C@@]34[C@@]5([C@](C(C(=O)CC5)(C)C)(CC[C@]3([C@@]2(CC1)C)[H])[H])C4)C)(C)[H])C)=O |
| SPLASH | splash10-0ly2-5215900000-ea2eeec18992b7fe11d8 |
| Source of Spectrum | E2-51-1176-5 |
| Wiley ID | 1556272 |