| SpectraBase Compound ID | 112OFsjF8WN |
|---|---|
| InChI | InChI=1S/C22H26O12/c1-8(20(29)30)12(24)6-11-14(21(31)32)15(25)9-4-2-3-5-10(9)19(11)34-22-18(28)17(27)16(26)13(7-23)33-22/h2-5,8,12-13,16-18,22-28H,6-7H2,1H3,(H,29,30)(H,31,32)/t8?,12?,13-,16-,17+,18-,22+/m0/s1 |
| InChIKey | PATFXJLZMVZPET-LLDRPULBSA-N |
| Mol Weight | 482.44 g/mol |
| Molecular Formula | C22H26O12 |
| Exact Mass | 482.142426 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 42acpE2EHpm |
|---|---|
| Name | RUBINAPHTHIN-C;2-CARBOXY-3-(3'-CARBOXY-2'-HYDROXY)-BUTYL-1,4-NAPHTHOHYDROQUINONE-4-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H26O12 |
| InChI | InChI=1S/C22H26O12/c1-8(20(29)30)12(24)6-11-14(21(31)32)15(25)9-4-2-3-5-10(9)19(11)34-22-18(28)17(27)16(26)13(7-23)33-22/h2-5,8,12-13,16-18,22-28H,6-7H2,1H3,(H,29,30)(H,31,32)/t8?,12?,13-,16-,17+,18-,22+/m0/s1 |
| InChIKey | PATFXJLZMVZPET-LLDRPULBSA-N |
| Literature Reference Author | M.J.LIOU,P.L.WU,T.S.WU |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,276(2002) |
| Literature Reference DOI | 10.1248/cpb.50.276 |
| Molecular Weight | 482.441 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN7905 |