L-Valine, N-(N-(4-((N2-(N2-(N-acetyl-L-seryl)-L-glutaminyl)-L-asparaginyl)amino)-2,4,5-trideoxy-5-phenyl-L-threo-pentonoyl)-L-valyl)-, methyl ester
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L-Valine, N-(N-(4-((N2-(N2-(N-acetyl-L-seryl)-L-glutaminyl)-L-asparaginyl)amino)-2,4,5-trideoxy-5-phenyl-L-threo-pentonoyl)-L-valyl)-, methyl ester
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CAS No:
127231-56-5
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Formula:
C36H56N8O12
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Chemical Name:
L-Valine, N-(N-(4-((N2-(N2-(N-acetyl-L-seryl)-L-glutaminyl)-L-asparaginyl)amino)-2,4,5-trideoxy-5-phenyl-L-threo-pentonoyl)-L-valyl)-, methyl ester
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Synonyms:
CHEMBL49026;AcSerGlnAsnPhe(CHOHCH2CO)ValValOMe;127231-56-5;L-Valine, N-(N-(4-((N2-(N2-(N-acetyl-L-seryl)-L-glutaminyl)-L-asparaginyl)amino)-2,4,5-trideoxy-5-phenyl-L-threo-pentonoyl)-L-valyl)-, methyl ester;AcSerGlnAsnPhe[CHOHCH2CO]ValValOMe;(N-(AcetylSerGlnAsn)-4-amino-3-hydroxy-1-oxo-5-phenylpentyl)ValValine methyl ester;[N-(AcetylSerGlnAsn)-4-amino-3-hydroxy-1-oxo-5-phenylpentyl]ValValine methyl ester;DTXSID00155483;BDBM50000698;N-Ac-L-Ser-L-Gln-L-Asn-[(3S,4S)-4-Amino*-3-hydroxy-5-phenylpentanoyl]-L-Val-L-Val-OMe;L-Valine, N-[N-[4(S)-[[N2-[N2-(N-acetyl-L-seryl)-L-glutaminyl]-L-asparaginyl]amino]-2,4,5-trideoxy-3(S)-hydroxy-5-phenylpentonoyl]-L-valyl]-, methyl ester;methyl (2S)-2-[[(2S)-2-[[(3S,4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxy-propanoyl]amino]-5-amino-5-oxo-pentanoyl]amino]-4-amino-4-oxo-butanoyl]amino]-3-hydroxy-5-phenyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate
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CAS No:
L-Valine, N-(N-(4-((N2-(N2-(N-acetyl-L-seryl)-L-glutaminyl)-L-asparaginyl)amino)-2,4,5-trideoxy-5-phenyl-L-threo-pentonoyl)-L-valyl)-, methyl ester Basic Attributes
792.9 g/mol
792.40176925 g/mol
DTXSID00155483
Computed Properties
Molecular Weight:792.9
XLogP3:-2.3
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:25
Exact Mass:792.40176925
Monoisotopic Mass:792.40176925
Topological Polar Surface Area:328
Heavy Atom Count:56
Complexity:1390
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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