| SpectraBase Compound ID | NwMPVljjwe |
|---|---|
| InChI | InChI=1S/C36H56O14/c1-17-29(50-31-27(41)26(40)25(39)22(14-37)49-31)30(44-3)28(42)32(47-17)48-19-6-9-33(2)18(12-19)4-5-21-20(33)7-10-34-15-46-35(13-24(38)45-16-35)23(34)8-11-36(21,34)43/h17-23,25-32,37,39-43H,4-16H2,1-3H3/t17-,18+,19-,20-,21+,22-,23-,25-,26+,27-,28-,29-,30-,31+,32-,33-,34-,35-,36-/m0/s1 |
| InChIKey | UMTVXISMEAIITJ-SVPYKJPYSA-N |
| Mol Weight | 712.8 g/mol |
| Molecular Formula | C36H56O14 |
| Exact Mass | 712.367006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | K1rjxLmZ1dj |
|---|---|
| Name | (20-R)-18,20-EPOXY-DIGITOXIGENIN_BETA-D-GLUCOSYL-(1->4)-ALPHA-L-THEVETOSIDE |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O14 |
| InChI | InChI=1S/C36H56O14/c1-17-29(50-31-27(41)26(40)25(39)22(14-37)49-31)30(44-3)28(42)32(47-17)48-19-6-9-33(2)18(12-19)4-5-21-20(33)7-10-34-15-46-35(13-24(38)45-16-35)23(34)8-11-36(21,34)43/h17-23,25-32,37,39-43H,4-16H2,1-3H3/t17-,18+,19-,20-,21+,22-,23-,25-,26+,27-,28-,29-,30-,31+,32-,33-,34-,35-,36-/m0/s1 |
| InChIKey | UMTVXISMEAIITJ-SVPYKJPYSA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI,A.S.C.WAN |
| Literature Reference Citation | PHYTOCHEM.,31,3189(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83472-B |
| Molecular Weight | 712.832 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ21520 |