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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
SpectraBase Compound ID Fi4QaVIPCUp
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
Mol Weight 446.5 g/mol
Molecular Formula C21H34O10
Exact Mass 446.215197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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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]