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(S)-2-[((2S,4R)-4-Hydroxy-1-pyridin-4-yl-pyrrolidine-2-carbonyl)-amino]-3-(1H-indol-3-yl)-propionic acid methyl ester
SpectraBase Compound ID DPYH097dlwy
InChI InChI=1S/C22H24N4O4/c1-30-22(29)19(10-14-12-24-18-5-3-2-4-17(14)18)25-21(28)20-11-16(27)13-26(20)15-6-8-23-9-7-15/h2-9,12,16,19-20,24,27H,10-11,13H2,1H3,(H,25,28)/t16-,19+,20+/m1/s1
InChIKey AUBRGGWNHUVAKF-UXPWSPDFSA-N
Mol Weight 408.46 g/mol
Molecular Formula C22H24N4O4
Exact Mass 408.179755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jdxno8m52C8
Name (S)-2-[((2S,4R)-4-Hydroxy-1-pyridin-4-yl-pyrrolidine-2-carbonyl)-amino]-3-(1H-indol-3-yl)-propionic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N4O4
InChI InChI=1S/C22H24N4O4/c1-30-22(29)19(10-14-12-24-18-5-3-2-4-17(14)18)25-21(28)20-11-16(27)13-26(20)15-6-8-23-9-7-15/h2-9,12,16,19-20,24,27H,10-11,13H2,1H3,(H,25,28)/t16-,19+,20+/m1/s1
InChIKey AUBRGGWNHUVAKF-UXPWSPDFSA-N
Molecular Weight 408.458 g/mol
SMILES N(C([C@]1(N(C[C@@](C1)(O)[H])c1ccncc1)[H])=O)[C@@](Cc1c[nH]c2c1cccc2)(C(=O)OC)[H]
SPLASH splash10-03di-0920200000-1c796d024204b157eebf
Source of Spectrum Y1-44-1548-7
Synonyms 2-[N-(1-Pyridin-4-yl)-4-hydroxy-2-pyrrolidinylcarbonylamino]-1-(indol-3-yl)propanoic acid methyl ester Methyl (S)-[(2S,4R)-4-Hydroxy-1-(pyridin-4-yl)pyrrolidine-2-carboxamido]-3-(1H-indol-3-yl)propanoate Methyl (2S)-2-({[(2S,4R)-4-hydroxy-1-(4-pyridinyl)pyrrolidinyl]carbonyl}amino)-3-(1H-indol-3-yl)propanoate
Wiley ID 1621311