| SpectraBase Compound ID | ChyyE7sEpAO |
|---|---|
| InChI | InChI=1S/C33H50O8/c1-19(35)41-25-22(36)17-29(3)23(30(25,4)18-34)10-11-32(6)24(29)9-8-20-21-16-28(2,27(39)40-7)12-14-33(21,26(37)38)15-13-31(20,32)5/h8,21-25,34,36H,9-18H2,1-7H3,(H,37,38)/t21-,22-,23?,24+,25-,28-,29-,30-,31+,32+,33-/m0/s1 |
| InChIKey | DPYLPCCKUFMBGG-IVBOJTFOSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C33H50O8 |
| Exact Mass | 574.350569 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 74UeuVZNIJ4 |
|---|---|
| Name | PHYTOLACCAGENIN-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H50O8 |
| InChI | InChI=1S/C33H50O8/c1-19(35)41-25-22(36)17-29(3)23(30(25,4)18-34)10-11-32(6)24(29)9-8-20-21-16-28(2,27(39)40-7)12-14-33(21,26(37)38)15-13-31(20,32)5/h8,21-25,34,36H,9-18H2,1-7H3,(H,37,38)/t21-,22-,23?,24+,25-,28-,29-,30-,31+,32+,33-/m0/s1 |
| InChIKey | DPYLPCCKUFMBGG-IVBOJTFOSA-N |
| Literature Reference Author | S.HARKAR,T.K.RAZDAN,E.S.WAIGHT |
| Literature Reference Citation | PHYTOCHEM.,23,2893(1984) |
| Literature Reference DOI | 10.1016/0031-9422(84)83036-8 |
| Molecular Weight | 574.755 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBK320 |