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Methyl-3,4,6-tri-o-acetyl-2-deoxy-2-phenylureido-beta-D-glucopyranoside

View entire compound with spectra: 2 NMR

Methyl-3,4,6-tri-o-acetyl-2-deoxy-2-phenylureido-beta-D-glucopyranoside
SpectraBase Compound ID LDQiorcDrwo
InChI InChI=1S/C20H26N2O9/c1-11(23)28-10-15-17(29-12(2)24)18(30-13(3)25)16(19(27-4)31-15)22-20(26)21-14-8-6-5-7-9-14/h5-9,15-19H,10H2,1-4H3,(H2,21,22,26)/t15-,16-,17-,18-,19-/m1/s1
InChIKey UAPOEVVPJHRDGY-FVVUREQNSA-N
Mol Weight 438.43 g/mol
Molecular Formula C20H26N2O9
Exact Mass 438.16383 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DLRUuMEClAx
Name Methyl-3,4,6-tri-o-acetyl-2-deoxy-2-phenylureido-beta-D-glucopyranoside
Comments Computed using HOSE algorithm
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Exact Mass 438.163830416 u
Formula C20H26N2O9
InChI InChI=1S/C20H26N2O9/c1-11(23)28-10-15-17(29-12(2)24)18(30-13(3)25)16(19(27-4)31-15)22-20(26)21-14-8-6-5-7-9-14/h5-9,15-19H,10H2,1-4H3,(H2,21,22,26)/t15-,16-,17-,18-,19-/m1/s1
InChIKey UAPOEVVPJHRDGY-FVVUREQNSA-N
Molecular Weight 438.433 g/mol
SMILES CO[C@]1([C@@]([C@]([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])(NC(=O)NC1=CC=CC=C1)[H])[H]