| SpectraBase Compound ID | 5OEVsDThSGv |
|---|---|
| InChI | InChI=1S/C40H60O13/c1-19-24(12-13-47-19)25-10-11-27-26(37(25)44)9-8-23-14-30(29(42)18-40(23,27)5)51-34-17-32(46-7)39(22(4)50-34)53-33-15-28(41)38(21(3)49-33)52-35-16-31(45-6)36(43)20(2)48-35/h8,12-13,20-22,25-36,38-39,41-43H,9-11,14-18H2,1-7H3/t20-,21-,22-,25?,26?,27?,28+,29+,30+,31+,32+,33+,34+,35-,36-,38-,39-,40-/m0/s1 |
| InChIKey | MUUBBCBSCRKBGH-PDYKLBFPSA-N |
| Mol Weight | 748.9 g/mol |
| Molecular Formula | C40H60O13 |
| Exact Mass | 748.403392 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B5Ay4VptvW7 |
|---|---|
| Name | CYNASCYROSIDE-D;CYNAJAPOGENIN-A-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXOPYRANOSYL-(1->4)-BETA-L-CYMAROPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H60O13 |
| InChI | InChI=1S/C40H60O13/c1-19-24(12-13-47-19)25-10-11-27-26(37(25)44)9-8-23-14-30(29(42)18-40(23,27)5)51-34-17-32(46-7)39(22(4)50-34)53-33-15-28(41)38(21(3)49-33)52-35-16-31(45-6)36(43)20(2)48-35/h8,12-13,20-22,25-36,38-39,41-43H,9-11,14-18H2,1-7H3/t20-,21-,22-,25?,26?,27?,28+,29+,30+,31+,32+,33+,34+,35-,36-,38-,39-,40-/m0/s1 |
| InChIKey | MUUBBCBSCRKBGH-PDYKLBFPSA-N |
| Literature Reference Author | H.YEO,Y.H.CHOI,J.KIM |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,847(2002) |
| Literature Reference DOI | 10.1248/cpb.50.847 |
| Molecular Weight | 748.909 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN8246 |