| SpectraBase Compound ID | 4N1OdLLICuq |
|---|---|
| InChI | InChI=1S/C21H36O7/c1-10-5-6-13-11(2)14(7-12-8-21(10,13)28-20(12,3)4)26-19-18(25)17(24)16(23)15(9-22)27-19/h10-19,22-25H,5-9H2,1-4H3/t10-,11-,12-,13-,14?,15-,16-,17+,18-,19-,21+/m1/s1 |
| InChIKey | KBKJKLDLFCZCQT-XKCTZRENSA-N |
| Mol Weight | 400.5 g/mol |
| Molecular Formula | C21H36O7 |
| Exact Mass | 400.246103 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6wZWb3bpdx0 |
|---|---|
| Name | LIGULOXIDYL-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O7 |
| InChI | InChI=1S/C21H36O7/c1-10-5-6-13-11(2)14(7-12-8-21(10,13)28-20(12,3)4)26-19-18(25)17(24)16(23)15(9-22)27-19/h10-19,22-25H,5-9H2,1-4H3/t10-,11-,12-,13-,14?,15-,16-,17+,18-,19-,21+/m1/s1 |
| InChIKey | KBKJKLDLFCZCQT-XKCTZRENSA-N |
| Literature Reference Author | S.SEO,Y.TOMITA,K.TORI,Y.YOSHIMURA |
| Literature Reference Citation | J.AM.CHEM.SOC.,100,3331(1978) |
| Literature Reference DOI | 10.1021/ja00479a014 |
| Molecular Weight | 400.513 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS10395 |