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3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)-4-[phenylmethoxycarbonyl-(phenylmethyl)amino]butanoic acid ethyl ester
SpectraBase Compound ID 10h6hfklKhH
InChI InChI=1S/C37H37N3O6/c1-2-44-35(41)34(39-36(42)45-25-28-16-8-4-9-17-28)32(31-22-38-33-21-13-12-20-30(31)33)24-40(23-27-14-6-3-7-15-27)37(43)46-26-29-18-10-5-11-19-29/h3-22,32,34,38H,2,23-26H2,1H3,(H,39,42)
InChIKey KRNYPKRAVPZTJE-UHFFFAOYSA-N
Mol Weight 619.7 g/mol
Molecular Formula C37H37N3O6
Exact Mass 619.268236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9VITEcruyN
Name 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)-4-[phenylmethoxycarbonyl-(phenylmethyl)amino]butanoic acid ethyl ester
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Formula C37H37N3O6
InChI InChI=1S/C37H37N3O6/c1-2-44-35(41)34(39-36(42)45-25-28-16-8-4-9-17-28)32(31-22-38-33-21-13-12-20-30(31)33)24-40(23-27-14-6-3-7-15-27)37(43)46-26-29-18-10-5-11-19-29/h3-22,32,34,38H,2,23-26H2,1H3,(H,39,42)
InChIKey KRNYPKRAVPZTJE-UHFFFAOYSA-N
Molecular Weight 619.718 g/mol
SMILES N(C(=O)OCc1ccccc1)C(C(c1c[nH]c2c1cccc2)CN(C(OCc1ccccc1)=O)Cc1ccccc1)C(=O)OCC
SPLASH splash10-001i-0009040000-81d44fec6f2a80936798
Source of Spectrum U1-2000-3056-17
Synonyms 4-[benzyl(carbobenzoxy)amino]-2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)butyric acid ethyl ester Ethyl 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)-4-[phenylmethoxycarbonyl-(phenylmethyl)amino]butanoate Ethyl 4-[benzyl(phenylmethoxycarbonyl)amino]-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate
Wiley ID 753945