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N,N-Diethyl-3,7-anhydro-2-[(tert-butoxycarbonyl)1mino]-2-deoxy-4,5;6,8-di-o-isopropylidene-D-erythro-L-gluco-octanamide
SpectraBase Compound ID CWn4Pafb6PE
InChI InChI=1S/C23H40N2O8/c1-10-25(11-2)19(26)14(24-20(27)33-21(3,4)5)16-18-17(31-23(8,9)32-18)15-13(29-16)12-28-22(6,7)30-15/h13-18H,10-12H2,1-9H3,(H,24,27)/t13-,14+,15-,16+,17+,18-/m1/s1
InChIKey RGHDEAHETGJFJO-BQULAQKPSA-N
Mol Weight 472.6 g/mol
Molecular Formula C23H40N2O8
Exact Mass 472.278466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9F1WiTltZi
Name N,N-Diethyl-3,7-anhydro-2-[(tert-butoxycarbonyl)1mino]-2-deoxy-4,5;6,8-di-o-isopropylidene-D-erythro-L-gluco-octanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.278466248 u
Formula C23H40N2O8
InChI InChI=1S/C23H40N2O8/c1-10-25(11-2)19(26)14(24-20(27)33-21(3,4)5)16-18-17(31-23(8,9)32-18)15-13(29-16)12-28-22(6,7)30-15/h13-18H,10-12H2,1-9H3,(H,24,27)/t13-,14+,15-,16+,17+,18-/m1/s1
InChIKey RGHDEAHETGJFJO-BQULAQKPSA-N
Molecular Weight 472.579 g/mol
SMILES [C@]1([C@@]2([C@@](OC(O2)(C)C)([C@]2([C@](O1)(COC(C)(C)O2)[H])[H])[H])[H])([C@@](C(N(CC)CC)=O)(NC(OC(C)(C)C)=O)[H])[H]