| SpectraBase Compound ID | IlxzDIoDeBS |
|---|---|
| InChI | InChI=1S/C34H41NO18/c1-16(36)43-14-25-27(45-17(2)37)29(47-19(4)39)31(49-21(6)41)33(52-25)44-15-26-28(46-18(3)38)30(48-20(5)40)32(50-22(7)42)34(53-26)51-24(13-35)23-11-9-8-10-12-23/h8-12,24-34H,14-15H2,1-7H3/t24-,25-,26-,27-,28-,29+,30-,31-,32+,33-,34+/m0/s1 |
| InChIKey | VOZGJFHALJQFKA-JPPNQKLFSA-N |
| Mol Weight | 751.7 g/mol |
| Molecular Formula | C34H41NO18 |
| Exact Mass | 751.232363 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ht1RoUZHSY |
|---|---|
| Name | AMYGDALIN-PERACETYLATED |
| Compound Number | B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H41NO18 |
| InChI | InChI=1S/C34H41NO18/c1-16(36)43-14-25-27(45-17(2)37)29(47-19(4)39)31(49-21(6)41)33(52-25)44-15-26-28(46-18(3)38)30(48-20(5)40)32(50-22(7)42)34(53-26)51-24(13-35)23-11-9-8-10-12-23/h8-12,24-34H,14-15H2,1-7H3/t24-,25-,26-,27-,28-,29+,30-,31-,32+,33-,34+/m0/s1 |
| InChIKey | VOZGJFHALJQFKA-JPPNQKLFSA-N |
| Literature Reference Author | P.F.WINTERHALTER,S.HARMSEN,F.TRANI |
| Literature Reference Citation | PHYTOCHEM.,30,3021(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)98244-X |
| Molecular Weight | 751.695 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN30986 |