| SpectraBase Compound ID | 1PtC72nGO0Q |
|---|---|
| InChI | InChI=1S/C31H34O17/c1-11-21(36)23(38)25(40)30(43-11)45-16-8-17(35)20-18(9-16)46-27(14-4-6-15(34)7-5-14)29(22(20)37)48-31-26(41)24(39)28(44-13(3)33)19(47-31)10-42-12(2)32/h4-9,11,19,21,23-26,28,30-31,34-36,38-41H,10H2,1-3H3/t11-,19-,21-,23+,24-,25+,26-,28-,30-,31+/m0/s1 |
| InChIKey | HBNFLLJEFIGGHR-RMMFCFMDSA-N |
| Mol Weight | 678.6 g/mol |
| Molecular Formula | C31H34O17 |
| Exact Mass | 678.1796 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FuUHECh68Vo |
|---|---|
| Name | KAEMPFEROL-3-(4'',6''-DIACETYL-BETA-GLUCOSIDE)-7-ALPHA-RHAMNOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H34O17 |
| InChI | InChI=1S/C31H34O17/c1-11-21(36)23(38)25(40)30(43-11)45-16-8-17(35)20-18(9-16)46-27(14-4-6-15(34)7-5-14)29(22(20)37)48-31-26(41)24(39)28(44-13(3)33)19(47-31)10-42-12(2)32/h4-9,11,19,21,23-26,28,30-31,34-36,38-41H,10H2,1-3H3/t11-,19-,21-,23+,24-,25+,26-,28-,30-,31+/m0/s1 |
| InChIKey | HBNFLLJEFIGGHR-RMMFCFMDSA-N |
| Literature Reference Author | S.OEZDEN,N.DUERUEST,K.TOKI,N.SAITO,T.HONDA |
| Literature Reference Citation | PHYTOCHEM.,49,241(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)01044-3 |
| Molecular Weight | 678.601 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU105 |