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132548-09-5 | L-Proline, L-leucyl-L-alanyl-
CAS No: 132548-09-5 Catalog No: AG0010TD MDL No:
Product Description
Catalog Number:
AG0010TD
Chemical Name:
L-Proline, L-leucyl-L-alanyl-
CAS Number:
132548-09-5
Molecular Formula:
C14H25N3O4
Molecular Weight:
299.3660
IUPAC Name:
(2S)-1-[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C14H25N3O4/c1-8(2)7-10(15)12(18)16-9(3)13(19)17-6-4-5-11(17)14(20)21/h8-11H,4-7,15H2,1-3H3,(H,16,18)(H,20,21)/t9-,10-,11-/m0/s1
InChI Key:
WSGXUIQTEZDVHJ-DCAQKATOSA-N
SMILES:
CC(C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)N)C
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
299.185g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
299.371g/mol
Monoisotopic Mass:
299.185g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9
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