![LONGISIDE-A;3-O-BETA-D-[6'-(3''-METHYLBUTANOATE)-2',3',4'-TRIACETOXY]-GLUCOPYRANOSYL-BETA-SITOSTEROL](/api/spectrum/1WdvYSDdijc/structure.png?h=300&w=458 "LONGISIDE-A;3-O-BETA-D-[6'-(3''-METHYLBUTANOATE)-2',3',4'-TRIACETOXY]-GLUCOPYRANOSYL-BETA-SITOSTEROL")
| SpectraBase Compound ID | EWZI52nqDuG |
|---|---|
| InChI | InChI=1S/C46H74O10/c1-12-32(27(4)5)14-13-28(6)36-17-18-37-35-16-15-33-24-34(19-21-45(33,10)38(35)20-22-46(36,37)11)55-44-43(54-31(9)49)42(53-30(8)48)41(52-29(7)47)39(56-44)25-51-40(50)23-26(2)3/h15,26-28,32,34-39,41-44H,12-14,16-25H2,1-11H3/t28-,32?,34+,35?,36?,37?,38?,39-,41-,42+,43-,44-,45+,46-/m1/s1 |
| InChIKey | ZSCXNRYYDHXMDL-YKQOKXLLSA-N |
| Mol Weight | 787.1 g/mol |
| Molecular Formula | C46H74O10 |
| Exact Mass | 786.528199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1WdvYSDdijc |
|---|---|
| Name | LONGISIDE-A;3-O-BETA-D-[6'-(3''-METHYLBUTANOATE)-2',3',4'-TRIACETOXY]-GLUCOPYRANOSYL-BETA-SITOSTEROL |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H74O10 |
| InChI | InChI=1S/C46H74O10/c1-12-32(27(4)5)14-13-28(6)36-17-18-37-35-16-15-33-24-34(19-21-45(33,10)38(35)20-22-46(36,37)11)55-44-43(54-31(9)49)42(53-30(8)48)41(52-29(7)47)39(56-44)25-51-40(50)23-26(2)3/h15,26-28,32,34-39,41-44H,12-14,16-25H2,1-11H3/t28-,32?,34+,35?,36?,37?,38?,39-,41-,42+,43-,44-,45+,46-/m1/s1 |
| InChIKey | ZSCXNRYYDHXMDL-YKQOKXLLSA-N |
| Literature Reference Author | M.S.ALI,M.SALEEM,W.AHMAD,M.PARVEZ,R.YAMDAGNI |
| Literature Reference Citation | PHYTOCHEM.,59,889(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00490-3 |
| Molecular Weight | 787.088 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN2917 |