| SpectraBase Compound ID | 5ymfTE70Dl3 |
|---|---|
| InChI | InChI=1S/C33H38O23/c34-6-14-17(38)20(41)24(45)31(53-14)50-7-15-18(39)21(42)25(46)33(54-15)55-28-19(40)16-12(37)4-9(51-32-26(47)22(43)23(44)29(56-32)30(48)49)5-13(16)52-27(28)8-1-2-10(35)11(36)3-8/h1-5,14-15,17-18,20-26,29,31-39,41-47H,6-7H2,(H,48,49)/t14-,15-,17-,18-,20+,21+,22-,23-,24-,25-,26+,29-,31-,32+,33+/m1/s1 |
| InChIKey | LCFUXBSUDLBRRL-MUGXTKMSSA-N |
| Mol Weight | 802.6 g/mol |
| Molecular Formula | C33H38O23 |
| Exact Mass | 802.180387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AQzPKCcU85X |
|---|---|
| Name | QUERCETIN-3-O-BETA-GENTIOBIOSIDE-7-O-BETA-GLUCURONIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H38O23 |
| InChI | InChI=1S/C33H38O23/c34-6-14-17(38)20(41)24(45)31(53-14)50-7-15-18(39)21(42)25(46)33(54-15)55-28-19(40)16-12(37)4-9(51-32-26(47)22(43)23(44)29(56-32)30(48)49)5-13(16)52-27(28)8-1-2-10(35)11(36)3-8/h1-5,14-15,17-18,20-26,29,31-39,41-47H,6-7H2,(H,48,49)/t14-,15-,17-,18-,20+,21+,22-,23-,24-,25-,26+,29-,31-,32+,33+/m1/s1 |
| InChIKey | LCFUXBSUDLBRRL-MUGXTKMSSA-N |
| Literature Reference Author | J.BUDZIANOWSKI |
| Literature Reference Citation | PHYTOCHEM.,30,1679(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84233-I |
| Molecular Weight | 802.651 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU27512 |