| SpectraBase Compound ID | 4gDafm7sbAF |
|---|---|
| InChI | InChI=1S/C34H42O7S2/c1-22(2)8-7-9-26(6)33-30-18-25(5)19-31(35)34(30)27(21-40-42(36,37)28-14-10-23(3)11-15-28)20-32(33)41-43(38,39)29-16-12-24(4)13-17-29/h8,10-19,26-27,32-33,35H,7,9,20-21H2,1-6H3/t26-,27-,32+,33-/m0/s1 |
| InChIKey | RPBYHGNWTVKJOL-LWYBVUOESA-N |
| Mol Weight | 626.8 g/mol |
| Molecular Formula | C34H42O7S2 |
| Exact Mass | 626.237196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K1CWlP49ekY |
|---|---|
| Name | 1-BETA,3-ALPHA-DITOSYLOXY-SERRULATANE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H42O7S2 |
| InChI | InChI=1S/C34H42O7S2/c1-22(2)8-7-9-26(6)33-30-18-25(5)19-31(35)34(30)27(21-40-42(36,37)28-14-10-23(3)11-15-28)20-32(33)41-43(38,39)29-16-12-24(4)13-17-29/h8,10-19,26-27,32-33,35H,7,9,20-21H2,1-6H3/t26-,27-,32+,33-/m0/s1 |
| InChIKey | RPBYHGNWTVKJOL-LWYBVUOESA-N |
| Literature Reference Author | Y.M.SYAH,E.L.GHISALBERTI |
| Literature Reference Citation | PHYTOCHEM.,45,1479(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00152-0 |
| Molecular Weight | 626.823 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP606 |