| SpectraBase Compound ID | 1Jw3YtqKrdq |
|---|---|
| InChI | InChI=1S/C37H48O20/c1-15-26(44)28(46)30(48)35(52-15)51-14-24-32(56-25(43)9-6-18-4-7-20(39)22(41)12-18)33(57-36-31(49)29(47)27(45)16(2)53-36)34(54-17(3)38)37(55-24)50-11-10-19-5-8-21(40)23(42)13-19/h4-9,12-13,15-16,24,26-37,39-42,44-49H,10-11,14H2,1-3H3/b9-6+/t15-,16-,24-,26-,27-,28+,29+,30+,31+,32-,33+,34-,35+,36-,37-/m0/s1 |
| InChIKey | RIHCCESRYIALPG-FLAYPNCFSA-N |
| Mol Weight | 812.8 g/mol |
| Molecular Formula | C37H48O20 |
| Exact Mass | 812.273894 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 | ABfNmOVuqUZ |
|---|---|
| Name | BRANDIOSIDE;[BETA-(3',4'-DIHYDROXYPHENYL)-ETHYL]-(2-O-ACETYL)-(3,6-O-DI-ALPHA-L-RHAMNOPYRANOSYL)-(4-O-CAFFEOYL)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H48O20 |
| InChI | InChI=1S/C37H48O20/c1-15-26(44)28(46)30(48)35(52-15)51-14-24-32(56-25(43)9-6-18-4-7-20(39)22(41)12-18)33(57-36-31(49)29(47)27(45)16(2)53-36)34(54-17(3)38)37(55-24)50-11-10-19-5-8-21(40)23(42)13-19/h4-9,12-13,15-16,24,26-37,39-42,44-49H,10-11,14H2,1-3H3/b9-6+/t15-,16-,24-,26-,27-,28+,29+,30+,31+,32-,33+,34-,35+,36-,37-/m0/s1 |
| InChIKey | RIHCCESRYIALPG-FLAYPNCFSA-N |
| Literature Reference Author | Z.D.HE,C.R.YANG |
| Literature Reference Citation | PHYTOCHEM.,30,701(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83759-E |
| Molecular Weight | 812.776 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU32368 |