| SpectraBase Compound ID | 3pJJ6XdTNNO |
|---|---|
| InChI | InChI=1S/C25H42O17/c1-2-10(5-3-4-6-14(28)29)39-25-22(19(34)16(31)12(7-26)40-25)42-24-21(36)18(33)17(32)13(41-24)9-38-23-20(35)15(30)11(27)8-37-23/h2,10-13,15-27,30-36H,1,3-9H2,(H,28,29)/t10-,11-,12-,13-,15+,16-,17-,18+,19+,20-,21-,22-,23+,24+,25-/m1/s1 |
| InChIKey | WHIYEEOTOKLQHR-QJQMMLPUSA-N |
| Mol Weight | 614.6 g/mol |
| Molecular Formula | C25H42O17 |
| Exact Mass | 614.2422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5J8RfCnEng |
|---|---|
| Name | ILICIFOLIOSIDE-C;(6R)-6-HYDROXY-7-OCTANOIC-ACID-6-O-BETA-D-XYLOPYRANOSYL-(1'''->6'')-O-BETA-D-GLUCOPYRANOSYL-(1''->2')-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H42O17 |
| InChI | InChI=1S/C25H42O17/c1-2-10(5-3-4-6-14(28)29)39-25-22(19(34)16(31)12(7-26)40-25)42-24-21(36)18(33)17(32)13(41-24)9-38-23-20(35)15(30)11(27)8-37-23/h2,10-13,15-27,30-36H,1,3-9H2,(H,28,29)/t10-,11-,12-,13-,15+,16-,17-,18+,19+,20-,21-,22-,23+,24+,25-/m1/s1 |
| InChIKey | WHIYEEOTOKLQHR-QJQMMLPUSA-N |
| Literature Reference Author | J.WU,S.ZHANG,J.HUANG,Q.XIAO,Q.LI,L.LONG,L.HUANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,1201(2003) |
| Literature Reference DOI | 10.1248/cpb.51.1201 |
| Molecular Weight | 614.598 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU20391 |