SpectraBase Spectrum ID |
FAPgvasEx0N |
Name |
Methyl (1,2:3,4:9,10-tri-o-isopropylidene-7-deoxy-L-glycero-L-allo-.alpha.,D-galacto-undecodialdo-1,5-pyranoside)-11,8-.beta.-furanoside |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
446.215197285 u |
Formula |
C21H34O10 |
InChI |
InChI=1S/C21H34O10/c1-19(2)26-12-10(24-17(23-7)15(12)29-19)8-9(22)11-13-14(28-20(3,4)27-13)16-18(25-11)31-21(5,6)30-16/h9-18,22H,8H2,1-7H3/t9-,10+,11+,12+,13-,14-,15+,16+,17+,18+/m0/s1 |
InChIKey |
ZNHGFLDEPCQVPM-HWVHOZRTSA-N |
Molecular Weight |
446.493 g/mol |
SMILES |
[C@]12([C@@]3([C@@](OC(O3)(C)C)(O[C@@]([C@@]1(OC(O2)(C)C)[H])([C@](C[C@@]1([C@@]2([C@@](OC(O2)(C)C)([C@@](O1)(OC)[H])[H])[H])[H])(O)[H])[H])[H])[H])[H] |