| SpectraBase Compound ID | 5bpYMbIimQd |
|---|---|
| InChI | InChI=1S/C22H34O13/c1-2-3-4-5-6-7-8-9-14(25)33-22-20(18(29)16(27)13(11-24)32-22)34-35-21-19(30)17(28)15(26)12(10-23)31-21/h3-4,6-9,12-13,15-24,26-30H,2,5,10-11H2,1H3/b4-3-,7-6+,9-8+/t12-,13+,15-,16+,17+,18-,19-,20+,21+,22-/m0/s1 |
| InChIKey | SSVXERNPBQKFCN-SZWSFRKXSA-N |
| Mol Weight | 506.5 g/mol |
| Molecular Formula | C22H34O13 |
| Exact Mass | 506.199941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A40UjOcFIcm |
|---|---|
| Name | (2E,4E,7Z)-DECA-2,4,7-TRIENOATE-2-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H34O13 |
| InChI | InChI=1S/C22H34O13/c1-2-3-4-5-6-7-8-9-14(25)33-22-20(18(29)16(27)13(11-24)32-22)34-35-21-19(30)17(28)15(26)12(10-23)31-21/h3-4,6-9,12-13,15-24,26-30H,2,5,10-11H2,1H3/b4-3-,7-6+,9-8+/t12-,13+,15-,16+,17+,18-,19-,20+,21+,22-/m0/s1 |
| InChIKey | SSVXERNPBQKFCN-SZWSFRKXSA-N |
| Literature Reference Author | M.X.HU,H.C.ZHANG,Y.WANG,S.M.LIU,L.LIU |
| Literature Reference Citation | MOLECULES,17,12651(2012) |
| Literature Reference DOI | 10.3390/molecules171112651 |
| Molecular Weight | 506.504 g/mol |
| Sample ID | 1550 |
| Solvent | CD3OD |