(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoic acid
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![(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ec4079bdbb384cda9d38fce2320b00df.png "(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoic acid")
(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoic acid
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CAS No:
123951-86-0
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Formula:
C25H38N6O10
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Chemical Name:
(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoic acid
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Synonyms:
H-Thr-Thr-Asn-Tyr-Abu-OH;Butanoic acid, L-threonyl-L-threonyl-L-asparaginyl-L-tyrosyl-L-2-amino-;123951-86-0;H-Thr-Thr-Asn-Tyr-alpha-Aminobutyric acid-OH;DTXSID30154161;H-Thr-Thr-Asn-Tyr-.alpha.-Aminobutyric acid-OH;H-Thr-Thr-Asn-Tyr-Abu-OH; H-Thr-Thr-Asn-Tyr-.alpha.-Aminobutyric acid-OH
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CAS No:
(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanoic acid Basic Attributes
582.6 g/mol
582.26494143 g/mol
DTXSID30154161
Computed Properties
Molecular Weight:582.6
XLogP3:-5
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:16
Exact Mass:582.26494143
Monoisotopic Mass:582.26494143
Topological Polar Surface Area:284
Heavy Atom Count:41
Complexity:942
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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