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819802-78-3 | L-Serine, L-leucyl-L-arginyl-L-lysyl-L-valyl-
CAS No: 819802-78-3 Catalog No: AG005G14 MDL No:
Product Description
Catalog Number:
AG005G14
Chemical Name:
L-Serine, L-leucyl-L-arginyl-L-lysyl-L-valyl-
CAS Number:
819802-78-3
Molecular Formula:
C26H51N9O7
Molecular Weight:
601.7392
IUPAC Name:
(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxypropanoic acid
InChI:
InChI=1S/C26H51N9O7/c1-14(2)12-16(28)21(37)32-18(9-7-11-31-26(29)30)22(38)33-17(8-5-6-10-27)23(39)35-20(15(3)4)24(40)34-19(13-36)25(41)42/h14-20,36H,5-13,27-28H2,1-4H3,(H,32,37)(H,33,38)(H,34,40)(H,35,39)(H,41,42)(H4,29,30,31)/t16-,17-,18-,19-,20-/m0/s1
InChI Key:
IQNNZFFPNSJEPS-HVTWWXFQSA-N
SMILES:
NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)N)CCCNC(=N)N
Properties
Complexity:
911
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
601.391g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
10
Isotope Atom Count:
0
Molecular Weight:
601.75g/mol
Monoisotopic Mass:
601.391g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
290A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.2
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