2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-4-[2-oxo-4-(phenylmethoxycarbonylamino)-1-pyrimidinyl]butyl]amino]acetic acid ethyl ester

SpectraBase Compound ID	6cE1O6tshqb
InChI	InChI=1S/C25H33N5O8/c1-5-36-20(31)15-26-21(32)18(27-24(35)38-25(2,3)4)11-13-30-14-12-19(28-22(30)33)29-23(34)37-16-17-9-7-6-8-10-17/h6-10,12,14,18H,5,11,13,15-16H2,1-4H3,(H,26,32)(H,27,35)(H,28,29,33,34)/t18-/m0/s1
InChIKey	AVRWFMIYCUPYDT-SFHVURJKSA-N Google Search
Mol Weight	531.6 g/mol
Molecular Formula	C25H33N5O8
Exact Mass	531.232913 g/mol

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SpectraBase Spectrum ID	26YDItnjkbQ
Name	2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-4-[2-oxo-4-(phenylmethoxycarbonylamino)-1-pyrimidinyl]butyl]amino]acetic acid ethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H33N5O8
InChI	InChI=1S/C25H33N5O8/c1-5-36-20(31)15-26-21(32)18(27-24(35)38-25(2,3)4)11-13-30-14-12-19(28-22(30)33)29-23(34)37-16-17-9-7-6-8-10-17/h6-10,12,14,18H,5,11,13,15-16H2,1-4H3,(H,26,32)(H,27,35)(H,28,29,33,34)/t18-/m0/s1
InChIKey	AVRWFMIYCUPYDT-SFHVURJKSA-N
Molecular Weight	531.566 g/mol
SMILES	N(C([C@](CCN1C(N=C(C=C1)NC(=O)OCc1ccccc1)=O)(NC(OC(C)(C)C)=O)[H])=O)CC(=O)OCC
SPLASH	splash10-004i-0910000000-a864e84e244511b53d9b
Source of Spectrum	J-62-5449-22
Synonyms	2-[[(2S)-4-[4-(benzyloxycarbonylamino)-2-keto-pyrimidin-1-yl]-2-(tert-butoxycarbonylamino)butanoyl]amino]acetic acid ethyl ester Ethyl 2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-[2-oxidanylidene-4-(phenylmethoxycarbonylamino)pyrimidin-1-yl]butanoyl]amino]ethanoate Ethyl 2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-[2-oxo-4-(phenylmethoxycarbonylamino)pyrimidin-1-yl]butanoyl]amino]acetate Ethyl 2-[[(2S)-4-[4-(benzyloxycarbonylamino)-2-oxo-pyrimidin-1-yl]-2-(tert-butoxycarbonylamino)butanoyl]amino]acetate
Wiley ID	1403459