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2-O-Benzyl-N-benzyloxycarbonyl-1,5-dideoxy-1,5-imino-4-O-(4-methoxybebnzyl)-D-mannitol
SpectraBase Compound ID 5Kk4AymgFbG
InChI InChI=1S/C29H33NO7/c1-34-24-14-12-23(13-15-24)19-36-28-25(17-31)30(29(33)37-20-22-10-6-3-7-11-22)16-26(27(28)32)35-18-21-8-4-2-5-9-21/h2-15,25-28,31-32H,16-20H2,1H3/t25-,26-,27-,28-/m1/s1
InChIKey IQIKZKQZKTYIMQ-BIYDSLDMSA-N
Mol Weight 507.6 g/mol
Molecular Formula C29H33NO7
Exact Mass 507.225702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jTBUMNRP7f
Name 2-O-Benzyl-N-benzyloxycarbonyl-1,5-dideoxy-1,5-imino-4-O-(4-methoxybebnzyl)-D-mannitol
Alternate Name(s) 2-O-Benzyl-N-benzyloxycarbonyl-1,5-dideoxy-1,5-imino-4-O-(4-methoxybenzyl)-D-mannitol benzyl (2R,3R,4R,5R)-5-(benzyloxy)-4-hydroxy-2-(hydroxymethyl)-3-[(4-methoxybenzyl)oxy]-1-piperidinecarboxylate
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Formula C29H33NO7
InChI InChI=1S/C29H33NO7/c1-34-24-14-12-23(13-15-24)19-36-28-25(17-31)30(29(33)37-20-22-10-6-3-7-11-22)16-26(27(28)32)35-18-21-8-4-2-5-9-21/h2-15,25-28,31-32H,16-20H2,1H3/t25-,26-,27-,28-/m1/s1
InChIKey IQIKZKQZKTYIMQ-BIYDSLDMSA-N
Molecular Weight 507.583 g/mol
SMILES O[C@]1([C@@]([C@@](CO)(N(C[C@]1(OCc1ccccc1)[H])C(OCc1ccccc1)=O)[H])(OCc1ccc(cc1)OC)[H])[H]
SPLASH splash10-00do-9900100000-105bce7c645c9a24ffc4
Source of Spectrum KC-1992-1964-12
Wiley ID 776748