| SpectraBase Compound ID | 8vmicMowNRB |
|---|---|
| InChI | InChI=1S/C36H62O11/c1-31(2)21-8-15-36(18-38)22(33(21,5)12-9-23(31)45-30-28(42)27(41)26(40)20(17-37)44-30)16-19(39)29(36)35(7)14-11-25(47-35)34(6)13-10-24(46-34)32(3,4)43/h19-30,37-43H,8-18H2,1-7H3/t19?,20-,21?,22?,23+,24?,25?,26-,27+,28-,29?,30+,33?,34?,35?,36?/m0/s1 |
| InChIKey | MWXVMMQNIINAKK-BFDRYXJZSA-N |
| Mol Weight | 670.9 g/mol |
| Molecular Formula | C36H62O11 |
| Exact Mass | 670.429213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F2PSSBuyYT6 |
|---|---|
| Name | 3-BETA,12-ALPHA,25,30-TETRAHYDROXY-14R,17S;20R,24S-DIEPOXYMALABARICANE-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H62O11 |
| InChI | InChI=1S/C36H62O11/c1-31(2)21-8-15-36(18-38)22(33(21,5)12-9-23(31)45-30-28(42)27(41)26(40)20(17-37)44-30)16-19(39)29(36)35(7)14-11-25(47-35)34(6)13-10-24(46-34)32(3,4)43/h19-30,37-43H,8-18H2,1-7H3/t19?,20-,21?,22?,23+,24?,25?,26-,27+,28-,29?,30+,33?,34?,35?,36?/m0/s1 |
| InChIKey | MWXVMMQNIINAKK-BFDRYXJZSA-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 | 670.882 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2557 |