| SpectraBase Compound ID | 3EVYwYh1VzJ |
|---|---|
| InChI | InChI=1S/C42H68O14/c1-36(2)13-14-41-20-53-42(25(41)15-36)12-8-24-37(3)10-9-27(38(4,19-44)23(37)7-11-39(24,5)40(42,6)16-26(41)45)56-35-33(51)31(49)29(47)22(55-35)18-52-34-32(50)30(48)28(46)21(17-43)54-34/h8,12,21-35,43-51H,7,9-11,13-20H2,1-6H3/t21-,22-,23-,24-,25?,26+,27+,28-,29-,30+,31+,32-,33-,34-,35+,37+,38+,39-,40+,41-,42+/m1/s1 |
| InChIKey | ACWRMVMYIHRKJI-OUYIJRCISA-N |
| Mol Weight | 797.0 g/mol |
| Molecular Formula | C42H68O14 |
| Exact Mass | 796.460907 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 | FXWKWvXYsI4 |
|---|---|
| Name | CLINOPOSAPONIN-X;13-BETA,28-EPOXY-16-BETA,23-DIHYDROXY-OLEAN-11-EN-3-BETA-YL-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O14 |
| InChI | InChI=1S/C42H68O14/c1-36(2)13-14-41-20-53-42(25(41)15-36)12-8-24-37(3)10-9-27(38(4,19-44)23(37)7-11-39(24,5)40(42,6)16-26(41)45)56-35-33(51)31(49)29(47)22(55-35)18-52-34-32(50)30(48)28(46)21(17-43)54-34/h8,12,21-35,43-51H,7,9-11,13-20H2,1-6H3/t21-,22-,23-,24-,25?,26+,27+,28-,29-,30+,31+,32-,33-,34-,35+,37+,38+,39-,40+,41-,42+/m1/s1 |
| InChIKey | ACWRMVMYIHRKJI-OUYIJRCISA-N |
| Literature Reference Author | F.MORI,T.MIYASE,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,36,1485(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89747-2 |
| Molecular Weight | 796.994 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU26429 |