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163277-80-3 | L-Threonine, N-acetyl-O-(1,1-dimethylethyl)-
CAS No: 163277-80-3 Catalog No: AG001TZB MDL No:MFCD00236771
Product Description
Catalog Number:
AG001TZB
Chemical Name:
L-Threonine, N-acetyl-O-(1,1-dimethylethyl)-
CAS Number:
163277-80-3
Molecular Formula:
C10H19NO4
Molecular Weight:
217.2622
MDL Number:
MFCD00236771
IUPAC Name:
(2S,3R)-2-acetamido-3-[(2-methylpropan-2-yl)oxy]butanoic acid
InChI:
InChI=1S/C10H19NO4/c1-6(15-10(3,4)5)8(9(13)14)11-7(2)12/h6,8H,1-5H3,(H,11,12)(H,13,14)/t6-,8+/m1/s1
InChI Key:
JTQQJUFULLOMEJ-SVRRBLITSA-N
SMILES:
CC(=O)N[C@@H]([C@H](OC(C)(C)C)C)C(=O)O
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
217.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.265g/mol
Monoisotopic Mass:
217.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Transport and signaling via the amino acid binding site of the yeast Gap1 amino acid transceptor. | Nature chemical biology 20090101 |
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