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Benzyl 5-o-benzyl-1-carboxyl-1-dehydro-2,3-isopropylidene-.beta.,D-ribofuranoside
SpectraBase Compound ID A1oDVkWEOok
InChI InChI=1S/C23H26O7/c1-22(2)29-19-18(15-26-13-16-9-5-3-6-10-16)28-23(21(24)25,20(19)30-22)27-14-17-11-7-4-8-12-17/h3-12,18-20H,13-15H2,1-2H3,(H,24,25)
InChIKey XFOOGQYHIKGMBV-UHFFFAOYSA-N
Mol Weight 414.45 g/mol
Molecular Formula C23H26O7
Exact Mass 414.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D8Ho8rDqrpC
Name Benzyl 5-o-benzyl-1-carboxyl-1-dehydro-2,3-isopropylidene-.beta.,D-ribofuranoside
Comments Computed using HOSE algorithm
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Exact Mass 414.167853170 u
Formula C23H26O7
InChI InChI=1S/C23H26O7/c1-22(2)29-19-18(15-26-13-16-9-5-3-6-10-16)28-23(21(24)25,20(19)30-22)27-14-17-11-7-4-8-12-17/h3-12,18-20H,13-15H2,1-2H3,(H,24,25)
InChIKey XFOOGQYHIKGMBV-UHFFFAOYSA-N
Molecular Weight 414.454 g/mol
SMILES C1(C2C(OC(O2)(C)C)C(O1)COCC=1C=CC=CC1)(C(=O)O)OCC=1C=CC=CC1