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827320-26-3 | L-Leucine, L-seryl-L-asparaginyl-
CAS No: 827320-26-3 Catalog No: AG00587B MDL No:
Product Description
Catalog Number:
AG00587B
Chemical Name:
L-Leucine, L-seryl-L-asparaginyl-
CAS Number:
827320-26-3
Molecular Formula:
C13H24N4O6
Molecular Weight:
332.3529
IUPAC Name:
(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoic acid
InChI:
InChI=1S/C13H24N4O6/c1-6(2)3-9(13(22)23)17-12(21)8(4-10(15)19)16-11(20)7(14)5-18/h6-9,18H,3-5,14H2,1-2H3,(H2,15,19)(H,16,20)(H,17,21)(H,22,23)/t7-,8-,9-/m0/s1
InChI Key:
FIDMVVBUOCMMJG-CIUDSAMLSA-N
SMILES:
OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)N)N
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
332.17g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
332.357g/mol
Monoisotopic Mass:
332.17g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
185A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.9
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