| SpectraBase Compound ID | 1E9jZmvFhMk |
|---|---|
| InChI | InChI=1S/C32H36O13/c1-2-20-21-14-26(35)40-11-10-18-5-8-23(34)24(13-18)43-19-6-3-17(4-7-19)9-12-41-30(39)22(21)16-42-31(20)45-32-29(38)28(37)27(36)25(15-33)44-32/h2-8,13,16,21,25,27-29,31-34,36-38H,9-12,14-15H2,1H3/b20-2-/t21-,25-,27-,28+,29-,31-,32+/m0/s1 |
| InChIKey | MCQFLJJLPSRQQT-GQBPQTHESA-N |
| Mol Weight | 628.6 g/mol |
| Molecular Formula | C32H36O13 |
| Exact Mass | 628.215591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVMlwJkPvhb |
|---|---|
| Name | INSULAROSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H36O13 |
| InChI | InChI=1S/C32H36O13/c1-2-20-21-14-26(35)40-11-10-18-5-8-23(34)24(13-18)43-19-6-3-17(4-7-19)9-12-41-30(39)22(21)16-42-31(20)45-32-29(38)28(37)27(36)25(15-33)44-32/h2-8,13,16,21,25,27-29,31-34,36-38H,9-12,14-15H2,1H3/b20-2-/t21-,25-,27-,28+,29-,31-,32+/m0/s1 |
| InChIKey | MCQFLJJLPSRQQT-GQBPQTHESA-N |
| Literature Reference Author | T.TANAHASHI,A.SHIMADA,N.NAGAKURA,K.INOUE,H.KUWAJIMA,K.TAKAIS HI,C.C.CHEN |
| Literature Reference Citation | PHYTOCHEM.,33,397(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85527-X |
| Molecular Weight | 628.630 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN6380 |