| SpectraBase Compound ID | FxyJeRvEqeh |
|---|---|
| InChI | InChI=1S/C34H44O19/c1-15-24(41)25(42)26(43)31(50-15)48-12-22-28(52-23(40)7-4-16-2-5-18(36)20(38)10-16)29(53-33-30(45)34(46,13-35)14-49-33)27(44)32(51-22)47-9-8-17-3-6-19(37)21(39)11-17/h2-7,10-11,15,22,24-33,35-39,41-46H,8-9,12-14H2,1H3/b7-4+/t15-,22-,24-,25+,26+,27-,28-,29-,30-,31+,32-,33-,34+/m0/s1 |
| InChIKey | DBGPKDZQZSWQHV-XEMSIEJGSA-N |
| Mol Weight | 756.7 g/mol |
| Molecular Formula | C34H44O19 |
| Exact Mass | 756.247679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GwBkU1HLokp |
|---|---|
| Name | #3;PEDICULARIOSIDE-A;1'-O-BETA-D-(3,4-DIHYDROXY-BETA-PHENYL)-ETHYL-4'-O-CAFFEOYL-BETA-D-APIOSYL-(1->3')-ALPHA-L-RHAMNOPYRANOSYL-(1->6')-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H44O19 |
| InChI | InChI=1S/C34H44O19/c1-15-24(41)25(42)26(43)31(50-15)48-12-22-28(52-23(40)7-4-16-2-5-18(36)20(38)10-16)29(53-33-30(45)34(46,13-35)14-49-33)27(44)32(51-22)47-9-8-17-3-6-19(37)21(39)11-17/h2-7,10-11,15,22,24-33,35-39,41-46H,8-9,12-14H2,1H3/b7-4+/t15-,22-,24-,25+,26+,27-,28-,29-,30-,31+,32-,33-,34+/m0/s1 |
| InChIKey | DBGPKDZQZSWQHV-XEMSIEJGSA-N |
| Literature Reference Author | L.ZIMIN,J.ZHONGJIAN |
| Literature Reference Citation | PHYTOCHEM.,30,1341(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95234-8 |
| Molecular Weight | 756.712 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU34318 |