(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]hexanoic acid
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![(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]hexanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/42012d7d7e714b1da402504857ea0d4e.png "(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]hexanoic acid")
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]hexanoic acid
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CAS No:
96914-16-8
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Formula:
C23H35FN6O4
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Chemical Name:
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]hexanoic acid
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Synonyms:
Lys-F-Trp-Lys;lysyl-5-fluorotryptophyl-lysine;lysyl-5-fluorotryptophyl-lysine, (D)-isomer;Tri (D);Tri (L);Lysyl-5-fluorotryptophyl-lysine;96914-16-8;L-Lysine, N2-(5-fluoro-N-L-lysyl-L-tryptophyl)-;Tri (L);Lys-F-trp-lys;Tri (D);DTXSID00914254;lysyl-5-fluoro-l-tryptophyllysine;N~2~-{2-[(2,6-Diamino-1-hydroxyhexylidene)amino]-3-(5-fluoro-1H-indol-3-yl)-1-hydroxypropylidene}lysine
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CAS No:
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]hexanoic acid Basic Attributes
478.6 g/mol
478.27038178 g/mol
Computed Properties
Molecular Weight:478.6
XLogP3:-2.3
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:15
Exact Mass:478.27038178
Monoisotopic Mass:478.27038178
Topological Polar Surface Area:189
Heavy Atom Count:34
Complexity:669
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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