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798540-37-1 | L-Lysine, L-leucyl-L-prolyl-L-leucyl-
CAS No: 798540-37-1 Catalog No: AG005GQ9 MDL No:
Product Description
Catalog Number:
AG005GQ9
Chemical Name:
L-Lysine, L-leucyl-L-prolyl-L-leucyl-
CAS Number:
798540-37-1
Molecular Formula:
C23H43N5O5
Molecular Weight:
469.6180
IUPAC Name:
(2S)-6-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-amino-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]hexanoic acid
InChI:
InChI=1S/C23H43N5O5/c1-14(2)12-16(25)22(31)28-11-7-9-19(28)21(30)27-18(13-15(3)4)20(29)26-17(23(32)33)8-5-6-10-24/h14-19H,5-13,24-25H2,1-4H3,(H,26,29)(H,27,30)(H,32,33)/t16-,17-,18-,19-/m0/s1
InChI Key:
YINKWMLVSYEKTK-VJANTYMQSA-N
SMILES:
NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)N)CC(C)C
Properties
Complexity:
670
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
469.326g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
469.627g/mol
Monoisotopic Mass:
469.326g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
168A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.5
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