| SpectraBase Compound ID | 6w99ZqCvafV |
|---|---|
| InChI | InChI=1S/C33H54O4/c1-21(34)36-26-14-17-31(8)23(28(26,4)5)11-18-32-20-29(6)15-10-22-27(2,3)25(35-9)13-16-30(22,7)24(29)12-19-33(31,32)37-32/h22-26H,10-20H2,1-9H3/t22?,23-,24?,25-,26+,29-,30-,31-,32+,33+/m0/s1 |
| InChIKey | YMYZAVKWXLWORD-LNJSWAAVSA-N |
| Mol Weight | 514.8 g/mol |
| Molecular Formula | C33H54O4 |
| Exact Mass | 514.40221 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2aY2WTwANDC |
|---|---|
| Name | 21.beta,-Acetoxy-13.alpha.,14.alpha.-epoxy-3.beta.-methoxy-Serratan |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H54O4 |
| InChI | InChI=1S/C33H54O4/c1-21(34)36-26-14-17-31(8)23(28(26,4)5)11-18-32-20-29(6)15-10-22-27(2,3)25(35-9)13-16-30(22,7)24(29)12-19-33(31,32)37-32/h22-26H,10-20H2,1-9H3/t22?,23-,24?,25-,26+,29-,30-,31-,32+,33+/m0/s1 |
| InChIKey | YMYZAVKWXLWORD-LNJSWAAVSA-N |
| Molecular Weight | 514.791 g/mol |
| SMILES | [C@]123[C@](C[C@@]4(CCC5[C@@](C4CC3)(CC[C@](OC)(C5(C)C)[H])C)C)(CC[C@@]3([C@@]1(CC[C@@](OC(=O)C)(C3(C)C)[H])C)[H])O2 |
| SPLASH | splash10-0079-0910100000-625ce8236cb3a9841a6d |
| Source of Spectrum | G4-64-1047-3 |
| Wiley ID | 1609134 |