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(R,R)-2-{4-[1-(Phenylmethoxycarbonyl)ethylamino]-1H-indol-3-yl}-1-(hydroxymethyl)ethylphenylacetamide
SpectraBase Compound ID 1wHMmYzqa6z
InChI InChI=1S/C29H31N3O4/c1-20(29(35)36-19-22-11-6-3-7-12-22)31-26-14-8-13-25-28(26)23(17-30-25)16-24(18-33)32-27(34)15-21-9-4-2-5-10-21/h2-14,17,20,24,30-31,33H,15-16,18-19H2,1H3,(H,32,34)/t20-,24-/m1/s1
InChIKey UYXSEEYEFGBMJG-HYBUGGRVSA-N
Mol Weight 485.58 g/mol
Molecular Formula C29H31N3O4
Exact Mass 485.231456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwBS7aoGNkD
Name (R,R)-2-{4-[1-(Phenylmethoxycarbonyl)ethylamino]-1H-indol-3-yl}-1-(hydroxymethyl)ethylphenylacetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H31N3O4
InChI InChI=1S/C29H31N3O4/c1-20(29(35)36-19-22-11-6-3-7-12-22)31-26-14-8-13-25-28(26)23(17-30-25)16-24(18-33)32-27(34)15-21-9-4-2-5-10-21/h2-14,17,20,24,30-31,33H,15-16,18-19H2,1H3,(H,32,34)/t20-,24-/m1/s1
InChIKey UYXSEEYEFGBMJG-HYBUGGRVSA-N
Molecular Weight 485.584 g/mol
SMILES N(c1c2c(C[C@](CO)(NC(=O)Cc3ccccc3)[H])c[nH]c2ccc1)[C@@](C(OCc1ccccc1)=O)(C)[H]
SPLASH splash10-000l-7604900000-6aa1d37fba422ddf3ad9
Source of Spectrum QE-6-3954-23
Synonyms benzyl (2R)-2-[(3-{(2R)-3-hydroxy-2-[(phenylacetyl)amino]propyl}-1H-indol-4-yl)amino]propanoate
Wiley ID 845206