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160489-02-1 | L-Proline, L-alanyl-L-prolylglycyl-
CAS No: 160489-02-1 Catalog No: AG001RYL MDL No:
Product Description
Catalog Number:
AG001RYL
Chemical Name:
L-Proline, L-alanyl-L-prolylglycyl-
CAS Number:
160489-02-1
Molecular Formula:
C15H24N4O5
Molecular Weight:
340.3749
IUPAC Name:
(2S)-1-[2-[[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carbonyl]amino]acetyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C15H24N4O5/c1-9(16)14(22)19-7-2-4-10(19)13(21)17-8-12(20)18-6-3-5-11(18)15(23)24/h9-11H,2-8,16H2,1H3,(H,17,21)(H,23,24)/t9-,10-,11-/m0/s1
InChI Key:
KVKHMUQDQMCYLX-DCAQKATOSA-N
SMILES:
O=C([C@@H]1CCCN1C(=O)[C@@H](N)C)NCC(=O)N1CCC[C@H]1C(=O)O
Properties
Complexity:
538
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
340.175g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
340.38g/mol
Monoisotopic Mass:
340.175g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.3
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