methyl (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]amino]butanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoate
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![methyl (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]amino]butanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4e263da6db5f43e8aef8b58281fa1581.png "methyl (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]amino]butanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoate")
methyl (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]amino]butanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoate
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CAS No:
123951-94-0
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Formula:
C26H40N6O8
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Chemical Name:
methyl (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]amino]butanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoate
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Synonyms:
H-Abu-Abu-Asn-Tyr-Abu-OCH3;123951-94-0;Butanoic acid, L-2-aminobutanoyl-L-2-aminobutanoyl-L-asparaginyl-L-tyrosyl-L-2-amino-, methyl ester;DTXSID70154165;H-alpha-Aminobutyric acid-alpha-Aminobutyric acid-Asn-Tyr-alpha-Aminobutyric acid-OCH3;H-.alpha.-Aminobutyric acid-.alpha.-Aminobutyric acid-Asn-Tyr-.alpha.-Aminobutyric acid-OCH3;H-.alpha.-Aminobutyric acid-.alpha.-Aminobutyric acid-Asn-Tyr-.alpha.-Aminobutyric acid-OCH3; H-Abu-Abu-Asn-Tyr-Abu-OCH3
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CAS No:
methyl (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]amino]butanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoate Basic Attributes
564.6 g/mol
564.29076226 g/mol
DTXSID70154165
Computed Properties
Molecular Weight:564.6
XLogP3:-0.1
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:17
Exact Mass:564.29076226
Monoisotopic Mass:564.29076226
Topological Polar Surface Area:232
Heavy Atom Count:40
Complexity:892
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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