| SpectraBase Compound ID | 28trRsy9y6A |
|---|---|
| InChI | InChI=1S/C27H38O14/c1-10-3-4-13-11(2)25(36)40-23(13)18-12(5-14(30)17(10)18)7-37-26-22(34)21(33)19(31)16(39-26)8-38-27(9-29)24(35)20(32)15(6-28)41-27/h5,11,13,15-16,18-24,26,28-29,31-35H,3-4,6-9H2,1-2H3/t11-,13-,15-,16-,18-,19-,20-,21+,22-,23-,24+,26-,27-/m0/s1 |
| InChIKey | KELHXUJPCIPENS-HLWPWYFGSA-N |
| Mol Weight | 586.6 g/mol |
| Molecular Formula | C27H38O14 |
| Exact Mass | 586.226156 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LLd3OdiXF8 |
|---|---|
| Name | CICHORIOSIDE-E;JACQUINELIN-15-O-BETA-D-FRUCTOFURANOSYL-(2->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O14 |
| InChI | InChI=1S/C27H38O14/c1-10-3-4-13-11(2)25(36)40-23(13)18-12(5-14(30)17(10)18)7-37-26-22(34)21(33)19(31)16(39-26)8-38-27(9-29)24(35)20(32)15(6-28)41-27/h5,11,13,15-16,18-24,26,28-29,31-35H,3-4,6-9H2,1-2H3/t11-,13-,15-,16-,18-,19-,20-,21+,22-,23-,24+,26-,27-/m0/s1 |
| InChIKey | KELHXUJPCIPENS-HLWPWYFGSA-N |
| Literature Reference Author | T.WARASHINA,T.MIYASE |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,1445(2008) |
| Literature Reference DOI | 10.1248/cpb.56.1445 |
| Molecular Weight | 586.590 g/mol |
| Sample ID | 2286 |
| Solvent | C5D5N |