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Benzyl [(3R,5R)-6-Benzyloxycarbonylamino-3-tert-butoxycarbonylamino-5-hydroxyhexanoyl-1-methylhydrazino]acetate
SpectraBase Compound ID 7gJxSZPOtXw
InChI InChI=1S/C29H40N4O8/c1-29(2,3)41-28(38)31-23(15-24(34)17-30-27(37)40-20-22-13-9-6-10-14-22)16-25(35)32-33(4)18-26(36)39-19-21-11-7-5-8-12-21/h5-14,23-24,34H,15-20H2,1-4H3,(H,30,37)(H,31,38)(H,32,35)/t23-,24-/m1/s1
InChIKey GWIMFEYRDJQYMM-DNQXCXABSA-N
Mol Weight 572.7 g/mol
Molecular Formula C29H40N4O8
Exact Mass 572.284614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dg8TQXJJr6X
Name Benzyl [(3R,5R)-6-Benzyloxycarbonylamino-3-tert-butoxycarbonylamino-5-hydroxyhexanoyl-1-methylhydrazino]acetate
Comments Less than 3 mono-isotopic peaks
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Formula C29H40N4O8
InChI InChI=1S/C29H40N4O8/c1-29(2,3)41-28(38)31-23(15-24(34)17-30-27(37)40-20-22-13-9-6-10-14-22)16-25(35)32-33(4)18-26(36)39-19-21-11-7-5-8-12-21/h5-14,23-24,34H,15-20H2,1-4H3,(H,30,37)(H,31,38)(H,32,35)/t23-,24-/m1/s1
InChIKey GWIMFEYRDJQYMM-DNQXCXABSA-N
Molecular Weight 572.659 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C[C@](CNC(=O)OCc1ccccc1)(O)[H])(CC(NN(CC(=O)OCc1ccccc1)C)=O)[H]
SPLASH splash10-0006-9000000000-301c4e661f3a65146a2d
Source of Spectrum SO-0-485-19
Synonyms benzyl 2-[(3R,5R)-6-{[(benzyloxy)carbonyl]amino}-3-{[(tert-butoxy)carbonyl]amino}-5-hydroxy-N'-methylhexanehydrazido]acetate
Wiley ID 1543128