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10167-18-7 | L-Leucine, glycylglycylglycyl-
CAS No: 10167-18-7 Catalog No: AG000554 MDL No:
Product Description
Catalog Number:
AG000554
Chemical Name:
L-Leucine, glycylglycylglycyl-
CAS Number:
10167-18-7
Molecular Formula:
C12H22N4O5
Molecular Weight:
302.3269
IUPAC Name:
(2S)-2-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-4-methylpentanoic acid
InChI:
InChI=1S/C12H22N4O5/c1-7(2)3-8(12(20)21)16-11(19)6-15-10(18)5-14-9(17)4-13/h7-8H,3-6,13H2,1-2H3,(H,14,17)(H,15,18)(H,16,19)(H,20,21)/t8-/m0/s1
InChI Key:
WOXKTGKPJQPSER-QMMMGPOBSA-N
SMILES:
NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)O)CC(C)C
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
302.159g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
302.331g/mol
Monoisotopic Mass:
302.159g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.8
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