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832088-89-8 | Glycinamide, N-acetylglycylglycyl-L-alanyl-L-alanylglycyl-
CAS No: 832088-89-8 Catalog No: AG004ZYY MDL No:
Product Description
Catalog Number:
AG004ZYY
Chemical Name:
Glycinamide, N-acetylglycylglycyl-L-alanyl-L-alanylglycyl-
CAS Number:
832088-89-8
Molecular Formula:
C16H27N7O7
Molecular Weight:
429.4283
IUPAC Name:
(2S)-2-[[2-[(2-acetamidoacetyl)amino]acetyl]amino]-N-[(2S)-1-[[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]propanamide
InChI:
InChI=1S/C16H27N7O7/c1-8(15(29)21-6-13(27)19-4-11(17)25)23-16(30)9(2)22-14(28)7-20-12(26)5-18-10(3)24/h8-9H,4-7H2,1-3H3,(H2,17,25)(H,18,24)(H,19,27)(H,20,26)(H,21,29)(H,22,28)(H,23,30)/t8-,9-/m0/s1
InChI Key:
ONPHUEIOOIJINL-IUCAKERBSA-N
SMILES:
O=C(N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N)C)C)CNC(=O)CNC(=O)C
Properties
Complexity:
695
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
429.197g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
429.434g/mol
Monoisotopic Mass:
429.197g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
218A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.9
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