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L-Serine, N-[(phenylmethoxy)carbonyl]-o-[2,3,6-tri-o-acetyl-4-o-(2,3,4,6-tetra-o-acetyl-.alpha.-D-glucopyranosyl)-.beta.-D-glucopyranosyl]-, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

L-Serine, N-[(phenylmethoxy)carbonyl]-o-[2,3,6-tri-o-acetyl-4-o-(2,3,4,6-tetra-o-acetyl-.alpha.-D-glucopyranosyl)-.beta.-D-glucopyranosyl]-, methyl ester
SpectraBase Compound ID 5xpPt0khkS1
InChI InChI=1S/C38H49NO22/c1-18(40)50-16-27-29(54-20(3)42)31(55-21(4)43)34(58-24(7)46)37(60-27)61-30-28(17-51-19(2)41)59-36(33(57-23(6)45)32(30)56-22(5)44)52-15-26(35(47)49-8)39-38(48)53-14-25-12-10-9-11-13-25/h9-13,26-34,36-37H,14-17H2,1-8H3,(H,39,48)
InChIKey WFRSQZBLMRDTLF-UHFFFAOYSA-N
Mol Weight 871.8 g/mol
Molecular Formula C38H49NO22
Exact Mass 871.274622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GULVVAW5RLh
Name L-Serine, N-[(phenylmethoxy)carbonyl]-o-[2,3,6-tri-o-acetyl-4-o-(2,3,4,6-tetra-o-acetyl-.alpha.-D-glucopyranosyl)-.beta.-D-glucopyranosyl]-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 871.274622200 u
Formula C38H49NO22
InChI InChI=1S/C38H49NO22/c1-18(40)50-16-27-29(54-20(3)42)31(55-21(4)43)34(58-24(7)46)37(60-27)61-30-28(17-51-19(2)41)59-36(33(57-23(6)45)32(30)56-22(5)44)52-15-26(35(47)49-8)39-38(48)53-14-25-12-10-9-11-13-25/h9-13,26-34,36-37H,14-17H2,1-8H3,(H,39,48)
InChIKey WFRSQZBLMRDTLF-UHFFFAOYSA-N
Molecular Weight 871.795 g/mol
SMILES C1(O[C@]2([C@](OC(C)=O)([C@](OC(C)=O)([C@]([C@@](O2)(COC(C)=O)[H])(OC(C)=O)[H])[H])[H])[H])C(OC(C)=O)C(OC(C)=O)C(OC1COC(C)=O)OC[C@](NC(OCC1=CC=CC=C1)=O)(C(OC)=O)[H]