| SpectraBase Compound ID | 4fblYcNQh6V |
|---|---|
| InChI | InChI=1S/C36H42O18/c1-16-26(43)13-24-25(34(44)45-11-10-23-8-9-27(48-18(3)38)28(12-23)49-19(4)39)14-47-35(30(16)24)54-36-33(52-22(7)42)32(51-21(6)41)31(50-20(5)40)29(53-36)15-46-17(2)37/h8-9,12,14,16,24,29-33,35-36H,10-11,13,15H2,1-7H3/t16-,24+,29-,30+,31-,32+,33-,35-,36+/m0/s1 |
| InChIKey | CQODIQMFKFSVKL-LPNIHWRQSA-N |
| Mol Weight | 762.7 g/mol |
| Molecular Formula | C36H42O18 |
| Exact Mass | 762.237114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Sl69ZjPZhw |
|---|---|
| Name | SYRINGOPICROSIDE_B_HEXAACETATE |
| Compound Number | 297 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H42O18 |
| InChI | InChI=1S/C36H42O18/c1-16-26(43)13-24-25(34(44)45-11-10-23-8-9-27(48-18(3)38)28(12-23)49-19(4)39)14-47-35(30(16)24)54-36-33(52-22(7)42)32(51-21(6)41)31(50-20(5)40)29(53-36)15-46-17(2)37/h8-9,12,14,16,24,29-33,35-36H,10-11,13,15H2,1-7H3/t16-,24+,29-,30+,31-,32+,33-,35-,36+/m0/s1 |
| InChIKey | CQODIQMFKFSVKL-LPNIHWRQSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 762.719 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ16258 |