| SpectraBase Compound ID | 5NXMm4mUIPW |
|---|---|
| InChI | InChI=1S/C46H70O18/c1-20-25(12-13-56-20)26-10-11-28-27(38(26)50)9-8-24-14-31(30(49)18-46(24,28)5)60-35-15-29(48)42(21(2)57-35)62-36-16-32(54-6)43(22(3)58-36)63-37-17-33(55-7)44(23(4)59-37)64-45-41(53)40(52)39(51)34(19-47)61-45/h8,12-13,21-23,26-37,39-45,47-49,51-53H,9-11,14-19H2,1-7H3/t21-,22+,23-,26?,27?,28?,29+,30+,31+,32-,33-,34+,35+,36-,37-,39+,40-,41+,42-,43+,44+,45-,46-/m0/s1 |
| InChIKey | CPUVYWYAIUVMMX-JNAFPOSCSA-N |
| Mol Weight | 911.0 g/mol |
| Molecular Formula | C46H70O18 |
| Exact Mass | 910.456215 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 | 65iUhgWhSkH |
|---|---|
| Name | CYNASCYROSIDE-E;#2;CYNAJAPOGENIN-A-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-DIGINOPYRANOSYL-(1->4)-BETA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H70O18 |
| InChI | InChI=1S/C46H70O18/c1-20-25(12-13-56-20)26-10-11-28-27(38(26)50)9-8-24-14-31(30(49)18-46(24,28)5)60-35-15-29(48)42(21(2)57-35)62-36-16-32(54-6)43(22(3)58-36)63-37-17-33(55-7)44(23(4)59-37)64-45-41(53)40(52)39(51)34(19-47)61-45/h8,12-13,21-23,26-37,39-45,47-49,51-53H,9-11,14-19H2,1-7H3/t21-,22+,23-,26?,27?,28?,29+,30+,31+,32-,33-,34+,35+,36-,37-,39+,40-,41+,42-,43+,44+,45-,46-/m0/s1 |
| InChIKey | CPUVYWYAIUVMMX-JNAFPOSCSA-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 | 911.051 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN8247 |