S-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyl] ethanethioate,2,2,2-trifluoroacetic acid
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S-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyl] ethanethioate,2,2,2-trifluoroacetic acid
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CAS No:
147529-77-9
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Formula:
C9H15F3N2O5S
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Chemical Name:
S-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyl] ethanethioate,2,2,2-trifluoroacetic acid
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Synonyms:
N-Serinyl-S-acetylcysteamine trifluoroacetate; Ethanethioic acid,S-(2-((2-amino-3-hydroxy-1-oxopropyl)amino)ethyl) ester,(S)-,mono(trifluoroacetate) (salt); S-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyl] ethanethioate;
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CAS No:
S-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyl] ethanethioate,2,2,2-trifluoroacetic acid Basic Attributes
320.28600
320.06537724
DTXSID90163739
Computed Properties
Molecular Weight:320.29
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:320.06537724
Monoisotopic Mass:320.06537724
Topological Polar Surface Area:155
Heavy Atom Count:20
Complexity:270
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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