| SpectraBase Compound ID | LljH5gTeW8y |
|---|---|
| InChI | InChI=1S/C26H38O12/c1-9-4-13(36-22-19(31)18(30)17(29)14(7-27)37-22)21(33)24(3)11(9)5-15-25-8-35-26(34,23(24)25)20(32)10(2)12(25)6-16(28)38-15/h4,10-15,17-23,27,29-34H,5-8H2,1-3H3/t10-,11+,12+,13+,14+,15-,17+,18-,19+,20-,21-,22+,23-,24-,25-,26-/m1/s1 |
| InChIKey | ISCNRGZXXBIIRS-GUVBQLCWSA-N |
| Mol Weight | 542.6 g/mol |
| Molecular Formula | C26H38O12 |
| Exact Mass | 542.236327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I3Fw5IJXwBQ |
|---|---|
| Name | CASTELOSIDE-A;CHAPARRIN-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 | C26H38O12 |
| InChI | InChI=1S/C26H38O12/c1-9-4-13(36-22-19(31)18(30)17(29)14(7-27)37-22)21(33)24(3)11(9)5-15-25-8-35-26(34,23(24)25)20(32)10(2)12(25)6-16(28)38-15/h4,10-15,17-23,27,29-34H,5-8H2,1-3H3/t10-,11+,12+,13+,14+,15-,17+,18-,19+,20-,21-,22+,23-,24-,25-,26-/m1/s1 |
| InChIKey | ISCNRGZXXBIIRS-GUVBQLCWSA-N |
| Literature Reference Author | S.K.CHAUDHURI,I.KUBO |
| Literature Reference Citation | PHYTOCHEM.,31,3961(1992) |
| Literature Reference DOI | 10.1016/S0031-9422(00)97563-0 |
| Molecular Weight | 542.581 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU28845 |