| SpectraBase Spectrum ID |
4zx94ckKr3C |
| Name |
Melilotoside, tetramethyl ether, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.178417854 u |
| Formula |
C20H28O8 |
| InChI |
InChI=1S/C20H28O8/c1-22-12-15-17(24-3)18(25-4)19(26-5)20(28-15)27-14-9-7-6-8-13(14)10-11-16(21)23-2/h6-11,15,17-20H,12H2,1-5H3/b11-10+/t15-,17-,18+,19-,20-/m1/s1 |
| InChIKey |
XMPHJKKBCWMQRV-CBCARJKPSA-N |
| Molecular Weight |
396.436 g/mol |
| SMILES |
C(\C=C\C1=C(C=CC=C1)O[C@]1([C@](OC)([C@@](OC)([C@](OC)([C@](O1)(COC)[H])[H])[H])[H])[H])(=O)OC |
