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832732-89-5 | L-Glutamine, L-prolylglycyl-L-glutaminylglycyl-
CAS No: 832732-89-5 Catalog No: AG0056HG MDL No:
Product Description
Catalog Number:
AG0056HG
Chemical Name:
L-Glutamine, L-prolylglycyl-L-glutaminylglycyl-
CAS Number:
832732-89-5
Molecular Formula:
C19H31N7O8
Molecular Weight:
485.4915
IUPAC Name:
(2S)-5-amino-2-[[2-[[(2S)-5-amino-5-oxo-2-[[2-[[(2S)-pyrrolidine-2-carbonyl]amino]acetyl]amino]pentanoyl]amino]acetyl]amino]-5-oxopentanoic acid
InChI:
InChI=1S/C19H31N7O8/c20-13(27)5-3-11(25-15(29)8-23-17(31)10-2-1-7-22-10)18(32)24-9-16(30)26-12(19(33)34)4-6-14(21)28/h10-12,22H,1-9H2,(H2,20,27)(H2,21,28)(H,23,31)(H,24,32)(H,25,29)(H,26,30)(H,33,34)/t10-,11-,12-/m0/s1
InChI Key:
MHWAOBRZIYPKJZ-SRVKXCTJSA-N
SMILES:
O=C(N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC(=O)N)CCC(=O)N)CNC(=O)[C@@H]1CCCN1
Properties
Complexity:
804
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
485.223g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
8
Isotope Atom Count:
0
Molecular Weight:
485.498g/mol
Monoisotopic Mass:
485.223g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
252A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-7.9
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