| SpectraBase Compound ID | 81KEJ8KoDJr |
|---|---|
| InChI | InChI=1S/C32H38O19/c1-10-19(37)23(41)26(44)30(47-10)46-9-17-21(39)24(42)29(51-31-25(43)20(38)15(36)8-45-31)32(49-17)50-28-22(40)18-14(35)6-13(34)7-16(18)48-27(28)11-2-4-12(33)5-3-11/h2-7,10,15,17,19-21,23-26,29-39,41-44H,8-9H2,1H3/t10-,15+,17+,19-,20-,21+,23+,24-,25+,26+,29+,30+,31-,32-/m0/s1 |
| InChIKey | LLPRITPJQPQXIR-BVDHFOMSSA-N |
| Mol Weight | 726.6 g/mol |
| Molecular Formula | C32H38O19 |
| Exact Mass | 726.200729 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BO6gYRA5KOS |
|---|---|
| Name | KAEMPFEROL-3-O-(2(G)-BETA-D-XYLOPYRANOSYL-RUTINOSIDE) |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H38O19 |
| InChI | InChI=1S/C32H38O19/c1-10-19(37)23(41)26(44)30(47-10)46-9-17-21(39)24(42)29(51-31-25(43)20(38)15(36)8-45-31)32(49-17)50-28-22(40)18-14(35)6-13(34)7-16(18)48-27(28)11-2-4-12(33)5-3-11/h2-7,10,15,17,19-21,23-26,29-39,41-44H,8-9H2,1H3/t10-,15+,17+,19-,20-,21+,23+,24-,25+,26+,29+,30+,31-,32-/m0/s1 |
| InChIKey | LLPRITPJQPQXIR-BVDHFOMSSA-N |
| Literature Reference Author | M.JUNG,J.CHOI,H.S.CHAE,J.Y.CHO,Y.D.KIM,K.M.HTWE,W.S.LEE,Y.W. CHIN,J.KIM,K.D.YOON |
| Literature Reference Citation | MOLECULES,20,358(2015) |
| Literature Reference DOI | 10.3390/molecules20010358 |
| Molecular Weight | 726.642 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWPA2032 |