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146321-27-9 | L-Alanine, L-alanyl-L-cysteinyl-
CAS No: 146321-27-9 Catalog No: AG001DW6 MDL No:
Product Description
Catalog Number:
AG001DW6
Chemical Name:
L-Alanine, L-alanyl-L-cysteinyl-
CAS Number:
146321-27-9
Molecular Formula:
C9H17N3O4S
Molecular Weight:
263.3140
IUPAC Name:
2-[[2-(2-aminopropanoylamino)-3-sulfanylpropanoyl]amino]propanoic acid
InChI:
InChI=1S/C9H17N3O4S/c1-4(10)7(13)12-6(3-17)8(14)11-5(2)9(15)16/h4-6,17H,3,10H2,1-2H3,(H,11,14)(H,12,13)(H,15,16)
InChI Key:
DECCMEWNXSNSDO-UHFFFAOYSA-N
SMILES:
SC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](N)C
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.094g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
263.312g/mol
Monoisotopic Mass:
263.094g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.6
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