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(3R,4R,5R)-5-Benzyloxy-3-methyl-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-4-(p-toluenesulfonamido)piperidin-2-one
SpectraBase Compound ID 2GLdFh3frbJ
InChI InChI=1S/C30H42N2O6S/c1-20(2)17-25(29(34)38-30(5,6)7)32-18-26(37-19-23-11-9-8-10-12-23)27(22(4)28(32)33)31-39(35,36)24-15-13-21(3)14-16-24/h8-16,20,22,25-27,31H,17-19H2,1-7H3/t22-,25+,26-,27-/m1/s1
InChIKey JPDIEBLYMSLBBI-WWUMMRACSA-N
Mol Weight 558.7 g/mol
Molecular Formula C30H42N2O6S
Exact Mass 558.276358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKYIRqDBjAh
Name (3R,4R,5R)-5-Benzyloxy-3-methyl-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-4-(p-toluenesulfonamido)piperidin-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42N2O6S
InChI InChI=1S/C30H42N2O6S/c1-20(2)17-25(29(34)38-30(5,6)7)32-18-26(37-19-23-11-9-8-10-12-23)27(22(4)28(32)33)31-39(35,36)24-15-13-21(3)14-16-24/h8-16,20,22,25-27,31H,17-19H2,1-7H3/t22-,25+,26-,27-/m1/s1
InChIKey JPDIEBLYMSLBBI-WWUMMRACSA-N
Molecular Weight 558.734 g/mol
SMILES N([C@@]1([C@](C(N(C[C@]1(OCc1ccccc1)[H])[C@@](CC(C)C)(C(=O)OC(C)(C)C)[H])=O)(C)[H])[H])S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-052f-9000200000-dfef213c54796c162ccd
Source of Spectrum KD-13-1003-19
Synonyms tert-Butyl (2S)-2-((3R,4R,5R)-5-(benzyloxy)-3-methyl-4-{[(4-methylphenyl)sulfonyl]amino}-2-oxopiperidinyl)-4-methylpentanoate
Wiley ID 1635207