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(2S)-1-[(2S)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid methyl ester
SpectraBase Compound ID 2az6w3h2byy
InChI InChI=1S/C25H37N3O6/c1-16(2)20(26-25(32)34-15-18-11-8-7-9-12-18)22(29)27(5)21(17(3)4)23(30)28-14-10-13-19(28)24(31)33-6/h7-9,11-12,16-17,19-21H,10,13-15H2,1-6H3,(H,26,32)/t19-,20-,21-/m0/s1
InChIKey FBYICENEGFYKJE-ACRUOGEOSA-N
Mol Weight 475.6 g/mol
Molecular Formula C25H37N3O6
Exact Mass 475.268236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13fdOI4lZMo
Name (2S)-1-[(2S)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid methyl ester
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Formula C25H37N3O6
InChI InChI=1S/C25H37N3O6/c1-16(2)20(26-25(32)34-15-18-11-8-7-9-12-18)22(29)27(5)21(17(3)4)23(30)28-14-10-13-19(28)24(31)33-6/h7-9,11-12,16-17,19-21H,10,13-15H2,1-6H3,(H,26,32)/t19-,20-,21-/m0/s1
InChIKey FBYICENEGFYKJE-ACRUOGEOSA-N
Molecular Weight 475.586 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@](C(N([C@](C(N1[C@](C(=O)OC)(CCC1)[H])=O)(C(C)C)[H])C)=O)(C(C)C)[H]
SPLASH splash10-0006-9111000000-9a6bd2de5db9cffdcf41
Source of Spectrum F-50-12105-7
Synonyms (2S)-1-[(2S)-3-methyl-2-[methyl-[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-1-oxobutyl]-2-pyrrolidinecarboxylic acid methyl ester Methyl (2S)-1-[(2S)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidine-2-carboxylate Methyl (2S)-1-[(2S)-3-methyl-2-[methyl-[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanoyl]pyrrolidine-2-carboxylate
Wiley ID 789878