| SpectraBase Spectrum ID |
9XvrGYP0OW0 |
| Name |
4,6-Octadienoic acid, 8-(.beta.-D-glucopyranosyloxy)-2,7-dimethyl-, (4E,6E)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
706.360401752 u |
| Formula |
C31H66O8Si5 |
| InChI |
InChI=1S/C31H66O8Si5/c1-24(20-18-19-21-25(2)30(32)39-44(15,16)17)22-33-31-29(38-43(12,13)14)28(37-42(9,10)11)27(36-41(6,7)8)26(35-31)23-34-40(3,4)5/h18-20,25-29,31H,21-23H2,1-17H3/b19-18+,24-20+/t25?,26-,27+,28+,29-,31-/m1/s1 |
| InChIKey |
RHKMWFVLZGJCQO-IZXBJJDLSA-N |
| SMILES |
C[Si](OC(C(C)C\C=C\C=C/(C)CO[C@]1([C@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@@](CO[Si](C)(C)C)(O1)[H])[H])[H])[H])[H])=O)(C)C |
