| SpectraBase Compound ID | 7lc5Q1mqdwh |
|---|---|
| InChI | InChI=1S/C33H52O9/c1-17(15-34)5-8-24(36)18(2)27-25(37)14-23-21-7-6-19-13-20(9-11-32(19,3)22(21)10-12-33(23,27)4)41-31-30(40)29(39)28(38)26(16-35)42-31/h6,17-18,20-23,26-31,34-35,38-40H,5,7-16H2,1-4H3/t17-,18+,20-,21+,22-,23-,26+,27-,28+,29-,30+,31+,32-,33-/m0/s1 |
| InChIKey | HIEQVPIRIOZQAG-WJUPOPKRSA-N |
| Mol Weight | 592.8 g/mol |
| Molecular Formula | C33H52O9 |
| Exact Mass | 592.361133 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IJFe4SFqNDl |
|---|---|
| Name | KRYPTOGENIN-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H52O9 |
| InChI | InChI=1S/C33H52O9/c1-17(15-34)5-8-24(36)18(2)27-25(37)14-23-21-7-6-19-13-20(9-11-32(19,3)22(21)10-12-33(23,27)4)41-31-30(40)29(39)28(38)26(16-35)42-31/h6,17-18,20-23,26-31,34-35,38-40H,5,7-16H2,1-4H3/t17-,18+,20-,21+,22-,23-,26+,27-,28+,29-,30+,31+,32-,33-/m0/s1 |
| InChIKey | HIEQVPIRIOZQAG-WJUPOPKRSA-N |
| Literature Reference Author | M.HARAGUCHI,A.P.Z.D.SANTOS,M.C.M.YOUNG,E.P.CHU |
| Literature Reference Citation | PHYTOCHEM.,36,1005(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90480-1 |
| Molecular Weight | 592.770 g/mol |
| Solvent | CDCl3:CD3OD |
| Source File Reference | UWMS26121 |