| SpectraBase Compound ID | 5gyTTwdkpQW |
|---|---|
| InChI | InChI=1S/C36H56O10/c1-31(30(43)44-6)13-15-36(29(41)42)16-14-34(4)20(21(36)17-31)7-8-24-32(2)11-10-25(46-28-27(40)26(39)22(38)18-45-28)33(3,19-37)23(32)9-12-35(24,34)5/h7,21-28,37-40H,8-19H2,1-6H3,(H,41,42)/t21?,22-,23?,24?,25?,26+,27-,28+,31+,32+,33+,34-,35-,36+/m1/s1 |
| InChIKey | NSIBODJHRJTEFG-UZLYNKSCSA-N |
| Mol Weight | 648.8 g/mol |
| Molecular Formula | C36H56O10 |
| Exact Mass | 648.387348 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GlQV19CJw1z |
|---|---|
| Name | PHYTOLACCOSIDE-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O10 |
| InChI | InChI=1S/C36H56O10/c1-31(30(43)44-6)13-15-36(29(41)42)16-14-34(4)20(21(36)17-31)7-8-24-32(2)11-10-25(46-28-27(40)26(39)22(38)18-45-28)33(3,19-37)23(32)9-12-35(24,34)5/h7,21-28,37-40H,8-19H2,1-6H3,(H,41,42)/t21?,22-,23?,24?,25?,26+,27-,28+,31+,32+,33+,34-,35-,36+/m1/s1 |
| InChIKey | NSIBODJHRJTEFG-UZLYNKSCSA-N |
| Literature Reference Author | S.S.KANG,W.S.WOO |
| Literature Reference Citation | PLANTA.MED.,53,338(1987) |
| Literature Reference DOI | 10.1055/s-2006-962732 |
| Molecular Weight | 648.835 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK263 |