SpectraBase Spectrum ID |
IdukEkFeTl6 |
Name |
Methyl-2,4-di-o-methyl-3-o-[(2,3-di-o-methyl.alpha.L-rhamnopyranosyl)-4-o-(2,3,4-tri-o-methyl.alpha.L-rhamnopyranosyl)].alpha.L-rhamnopyranoside |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
568.309491593 u |
Formula |
C26H48O13 |
InChI |
InChI=1S/C26H48O13/c1-12-15(27-4)18(29-6)21(31-8)25(36-12)38-17-14(3)37-26(22(32-9)19(17)30-7)39-20-16(28-5)13(2)35-24(34-11)23(20)33-10/h12-26H,1-11H3/t12-,13-,14-,15-,16-,17-,18+,19+,20+,21+,22+,23+,24+,25-,26-/m0/s1 |
InChIKey |
ICZMSLIUYDPQPM-UNURNPCESA-N |
Molecular Weight |
568.657 g/mol |
SMILES |
[C@]1([C@@](O[C@]([C@@]([C@@]1(OC)[H])(OC)[H])(O[C@@]1([C@@](OC)([C@@](OC)([C@@](O[C@]1(C)[H])(O[C@@]1([C@]([C@@](O[C@]([C@@]1(OC)[H])(OC)[H])(C)[H])(OC)[H])[H])[H])[H])[H])[H])[H])(C)[H])(OC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878499 |