| SpectraBase Compound ID | 7PU552ZNgtE |
|---|---|
| InChI | InChI=1S/C57H84O20/c1-29(59)36-19-22-57(65)55(36,6)42(74-43(60)16-15-33-13-11-10-12-14-33)27-41-54(5)20-18-35(23-34(54)17-21-56(41,57)64)72-44-24-37(66-7)50(30(2)69-44)75-45-25-38(67-8)51(31(3)70-45)76-46-26-39(68-9)52(32(4)71-46)77-53-49(63)48(62)47(61)40(28-58)73-53/h10-17,30-32,35-42,44-53,58,61-65H,18-28H2,1-9H3/b16-15+/t30-,31+,32-,35+,36+,37+,38-,39-,40+,41-,42-,44+,45-,46+,47+,48-,49+,50-,51+,52-,53-,54+,55+,56+,57-/m1/s1 |
| InChIKey | PRBGNEILGRVDCR-ULIFXCDTSA-N |
| Mol Weight | 1089.3 g/mol |
| Molecular Formula | C57H84O20 |
| Exact Mass | 1088.555595 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 | ACabVu5bSr4 |
|---|---|
| Name | #8;SYRIACOSIDE-G;IKEMAGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H84O20 |
| InChI | InChI=1S/C57H84O20/c1-29(59)36-19-22-57(65)55(36,6)42(74-43(60)16-15-33-13-11-10-12-14-33)27-41-54(5)20-18-35(23-34(54)17-21-56(41,57)64)72-44-24-37(66-7)50(30(2)69-44)75-45-25-38(67-8)51(31(3)70-45)76-46-26-39(68-9)52(32(4)71-46)77-53-49(63)48(62)47(61)40(28-58)73-53/h10-17,30-32,35-42,44-53,58,61-65H,18-28H2,1-9H3/b16-15+/t30-,31+,32-,35+,36+,37+,38-,39-,40+,41-,42-,44+,45-,46+,47+,48-,49+,50-,51+,52-,53-,54+,55+,56+,57-/m1/s1 |
| InChIKey | PRBGNEILGRVDCR-ULIFXCDTSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,57,177(2009) |
| Literature Reference DOI | 10.1248/cpb.57.177 |
| Molecular Weight | 1089.282 g/mol |
| Sample ID | 2241 |
| Solvent | C5D5N |