| SpectraBase Compound ID | DT6kpvzsD9C |
|---|---|
| InChI | InChI=1S/C28H32O17/c1-40-10-5-13(33)17-14(6-10)41-24(9-2-3-11(31)12(32)4-9)26(19(17)35)45-28-23(39)21(37)25(16(8-30)43-28)44-27-22(38)20(36)18(34)15(7-29)42-27/h2-6,15-16,18,20-23,25,27-34,36-39H,7-8H2,1H3/t15-,16+,18-,20+,21+,22-,23+,25+,27+,28-/m0/s1 |
| InChIKey | LSPBTBSEMHJXDA-APIXKHQMSA-N |
| Mol Weight | 640.5 g/mol |
| Molecular Formula | C28H32O17 |
| Exact Mass | 640.16395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HlYi8xDAinc |
|---|---|
| Name | NERVILIFORDIN_C;3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H32O17 |
| InChI | InChI=1S/C28H32O17/c1-40-10-5-13(33)17-14(6-10)41-24(9-2-3-11(31)12(32)4-9)26(19(17)35)45-28-23(39)21(37)25(16(8-30)43-28)44-27-22(38)20(36)18(34)15(7-29)42-27/h2-6,15-16,18,20-23,25,27-34,36-39H,7-8H2,1H3/t15-,16+,18-,20+,21+,22-,23+,25+,27+,28-/m0/s1 |
| InChIKey | LSPBTBSEMHJXDA-APIXKHQMSA-N |
| Literature Reference Author | L.W.TIAN,Y.PEI,Y.J.ZHANG,Y.F.WANG,C.R.YANG |
| Literature Reference Citation | J.NAT.PROD.,72,1057(2009) |
| Literature Reference DOI | 10.1021/np800760p |
| Molecular Weight | 640.552 g/mol |
| Sample ID | 32744 |
| Solvent | DMSO-D6 |