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88908-30-9 | L-Alaninamide, L-lysyl-N-(1-carboxyethoxy)-, (S)-
CAS No: 88908-30-9 Catalog No: AG0048W7 MDL No:
Product Description
Catalog Number:
AG0048W7
Chemical Name:
L-Alaninamide, L-lysyl-N-(1-carboxyethoxy)-, (S)-
CAS Number:
88908-30-9
Molecular Formula:
C12H24N4O5
Molecular Weight:
304.3428
IUPAC Name:
2-[2-(2,6-diaminohexanoylamino)propanoylamino]oxypropanoic acid
InChI:
InChI=1S/C12H24N4O5/c1-7(10(17)16-21-8(2)12(19)20)15-11(18)9(14)5-3-4-6-13/h7-9H,3-6,13-14H2,1-2H3,(H,15,18)(H,16,17)(H,19,20)
InChI Key:
BBPADACBYVGUFY-UHFFFAOYSA-N
SMILES:
C[C@@H](C(=O)NOC(C(=O)O)C)NC(=O)[C@H](CCCCN)N
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.175g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
304.347g/mol
Monoisotopic Mass:
304.175g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
157A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.7
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