| SpectraBase Compound ID | EtTNY0UT837 |
|---|---|
| InChI | InChI=1S/C36H64O11/c1-31(2)21-9-13-34(6)22(33(21,5)14-11-24(31)46-30-28(42)27(41)26(40)20(18-37)45-30)17-19(38)29(34)35(7,44)15-10-23(39)36(8)16-12-25(47-36)32(3,4)43/h19-30,37-44H,9-18H2,1-8H3/t19?,20-,21?,22?,23?,24+,25?,26-,27+,28-,29?,30+,33?,34?,35?,36?/m0/s1 |
| InChIKey | KBWCXLKUIPNJBE-MHMTVILFSA-N |
| Mol Weight | 672.9 g/mol |
| Molecular Formula | C36H64O11 |
| Exact Mass | 672.444863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8FoMWIOb0rg |
|---|---|
| Name | 3-BETA,12-ALPHA,14,17,25-PENTAHYDROXY-20R,24S-EPOXYMALABARICANE-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H64O11 |
| InChI | InChI=1S/C36H64O11/c1-31(2)21-9-13-34(6)22(33(21,5)14-11-24(31)46-30-28(42)27(41)26(40)20(18-37)45-30)17-19(38)29(34)35(7,44)15-10-23(39)36(8)16-12-25(47-36)32(3,4)43/h19-30,37-44H,9-18H2,1-8H3/t19?,20-,21?,22?,23?,24+,25?,26-,27+,28-,29?,30+,33?,34?,35?,36?/m0/s1 |
| InChIKey | KBWCXLKUIPNJBE-MHMTVILFSA-N |
| Literature Reference Author | F.FAINI,M.CASTILLO,R.TORRES,G.D.MONACHE,E.GACS-BAITZ |
| Literature Reference Citation | PHYTOCHEM.,40,885(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00056-D |
| Molecular Weight | 672.898 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2558 |