| SpectraBase Compound ID | KZCbSgVS7gF |
|---|---|
| InChI | InChI=1S/C31H28O14/c1-41-20-10-15(5-8-18(20)34)29-30(26(38)24-19(35)11-17(33)12-21(24)43-29)45-31-28(40)27(39)25(37)22(44-31)13-42-23(36)9-4-14-2-6-16(32)7-3-14/h2-12,22,25,27-28,31-35,37,39-40H,13H2,1H3/b9-4+/t22-,25-,27+,28-,31+/m1/s1 |
| InChIKey | TVMGLJJYKIHJNJ-SETHOQODSA-N |
| Mol Weight | 624.55 g/mol |
| Molecular Formula | C31H28O14 |
| Exact Mass | 624.147906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2irreZWqJG6 |
|---|---|
| Name | ISORHAMNETIN-3-O-(6''-O-COUMAROYL)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H28O14 |
| InChI | InChI=1S/C31H28O14/c1-41-20-10-15(5-8-18(20)34)29-30(26(38)24-19(35)11-17(33)12-21(24)43-29)45-31-28(40)27(39)25(37)22(44-31)13-42-23(36)9-4-14-2-6-16(32)7-3-14/h2-12,22,25,27-28,31-35,37,39-40H,13H2,1H3/b9-4+/t22-,25-,27+,28-,31+/m1/s1 |
| InChIKey | TVMGLJJYKIHJNJ-SETHOQODSA-N |
| Literature Reference Author | C.WAN,S.ZHOU |
| Literature Reference Citation | TROP.J.PHARM.RES.,12,549(2013) |
| Molecular Weight | 624.555 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR13723 |