| SpectraBase Compound ID | 5UA7RKU7ROG |
|---|---|
| InChI | InChI=1S/C22H26O13/c1-8-4-13(25)22(31)2-3-32-20(14(8)22)35-21-18(29)17(28)16(27)12(34-21)7-33-19(30)9-5-10(23)15(26)11(24)6-9/h2-6,12-14,16-18,20-21,23-29,31H,7H2,1H3/t12-,13+,14-,16-,17+,18-,20-,21+,22+/m0/s1 |
| InChIKey | NLLSXIMBFCAVJD-OALUVZAVSA-N |
| Mol Weight | 498.44 g/mol |
| Molecular Formula | C22H26O13 |
| Exact Mass | 498.137341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ClwOxqcZpG7 |
|---|---|
| Name | 6-O-GALLOYL-7,8-DEHYDROHARPAGIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H26O13 |
| InChI | InChI=1S/C22H26O13/c1-8-4-13(25)22(31)2-3-32-20(14(8)22)35-21-18(29)17(28)16(27)12(34-21)7-33-19(30)9-5-10(23)15(26)11(24)6-9/h2-6,12-14,16-18,20-21,23-29,31H,7H2,1H3/t12-,13+,14-,16-,17+,18-,20-,21+,22+/m0/s1 |
| InChIKey | NLLSXIMBFCAVJD-OALUVZAVSA-N |
| Literature Reference Author | L.O.A.MANGURO,P.LEMMEN,P.HAO |
| Literature Reference Citation | REC.NAT.PROD.,5,147(2011) |
| Molecular Weight | 498.441 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT15362 |