| SpectraBase Compound ID | L6Hi0XEZscJ |
|---|---|
| InChI | InChI=1S/C68H102O26/c1-32(70)41-20-23-68(79)66(41,8)49(89-50(74)17-16-38-14-12-11-13-15-38)30-48-65(7)21-19-40(24-39(65)18-22-67(48,68)78)87-51-25-42(71)60(33(2)82-51)91-54-28-45(80-9)62(36(5)85-54)93-53-27-44(73)59(34(3)84-53)90-52-26-43(72)61(35(4)83-52)92-55-29-46(81-10)63(37(6)86-55)94-64-58(77)57(76)56(75)47(31-69)88-64/h11-18,33-37,40-49,51-64,69,71-73,75-79H,19-31H2,1-10H3/b17-16+/t33-,34-,35-,36-,37+,40-,41-,42+,43+,44-,45+,46-,47-,48+,49+,51+,52+,53+,54+,55-,56-,57+,58-,59-,60-,61-,62-,63+,64+,65-,66-,67-,68+/m0/s1 |
| InChIKey | OLWIWORNBAWOFX-KMOVILEVSA-N |
| Mol Weight | 1335.5 g/mol |
| Molecular Formula | C68H102O26 |
| Exact Mass | 1334.665933 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 | HXTTbxmLTUH |
|---|---|
| Name | IKEMAGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXOPYRANOSYL-(1->4)-BETA-D-CANAROPYRANOSYL-(1->4)-BETA-D-CYMA |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H102O26 |
| InChI | InChI=1S/C68H102O26/c1-32(70)41-20-23-68(79)66(41,8)49(89-50(74)17-16-38-14-12-11-13-15-38)30-48-65(7)21-19-40(24-39(65)18-22-67(48,68)78)87-51-25-42(71)60(33(2)82-51)91-54-28-45(80-9)62(36(5)85-54)93-53-27-44(73)59(34(3)84-53)90-52-26-43(72)61(35(4)83-52)92-55-29-46(81-10)63(37(6)86-55)94-64-58(77)57(76)56(75)47(31-69)88-64/h11-18,33-37,40-49,51-64,69,71-73,75-79H,19-31H2,1-10H3/b17-16+/t33-,34-,35-,36-,37+,40-,41-,42+,43+,44-,45+,46-,47-,48+,49+,51+,52+,53+,54+,55-,56-,57+,58-,59-,60-,61-,62-,63+,64+,65-,66-,67-,68+/m0/s1 |
| InChIKey | OLWIWORNBAWOFX-KMOVILEVSA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,1017(2000) |
| Literature Reference DOI | 10.1248/cpb.48.1017 |
| Molecular Weight | 1335.542 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4358 |