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250591-22-1 | L-Lysine, L-lysyl-L-arginyl-L-lysyl-
CAS No: 250591-22-1 Catalog No: AG002QAJ MDL No:
Product Description
Catalog Number:
AG002QAJ
Chemical Name:
L-Lysine, L-lysyl-L-arginyl-L-lysyl-
CAS Number:
250591-22-1
Molecular Formula:
C24H50N10O5
Molecular Weight:
558.7178
IUPAC Name:
(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]hexanoic acid
InChI:
InChI=1S/C24H50N10O5/c25-12-4-1-8-16(28)20(35)32-18(11-7-15-31-24(29)30)21(36)33-17(9-2-5-13-26)22(37)34-19(23(38)39)10-3-6-14-27/h16-19H,1-15,25-28H2,(H,32,35)(H,33,36)(H,34,37)(H,38,39)(H4,29,30,31)/t16-,17-,18-,19-/m0/s1
InChI Key:
DGCIKQDHDCFHFT-VJANTYMQSA-N
SMILES:
NCCCC[C@@H](C(=O)N[C@H](C(=O)O)CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)N)CCCNC(=N)N
Properties
Complexity:
764
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
558.397g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
10
Isotope Atom Count:
0
Molecular Weight:
558.729g/mol
Monoisotopic Mass:
558.397g/mol
Rotatable Bond Count:
23
Topological Polar Surface Area:
293A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.7
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