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246231-57-2 | L-Cysteine, L-cysteinylglycyl-
CAS No: 246231-57-2 Catalog No: AG002OUL MDL No:
Product Description
Catalog Number:
AG002OUL
Chemical Name:
L-Cysteine, L-cysteinylglycyl-
CAS Number:
246231-57-2
Molecular Formula:
C8H15N3O4S2
Molecular Weight:
281.3524
IUPAC Name:
(2R)-2-[[2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]acetyl]amino]-3-sulfanylpropanoic acid
InChI:
InChI=1S/C8H15N3O4S2/c9-4(2-16)7(13)10-1-6(12)11-5(3-17)8(14)15/h4-5,16-17H,1-3,9H2,(H,10,13)(H,11,12)(H,14,15)/t4-,5-/m0/s1
InChI Key:
URDUGPGPLNXXES-WHFBIAKZSA-N
SMILES:
SC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CS)N
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
281.05g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
281.345g/mol
Monoisotopic Mass:
281.05g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.1
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