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116331-70-5

116331-70-5 | Glycine, L-tyrosyl-L-phenylalanyl-

CAS No: 116331-70-5 Catalog No: AG000C8D MDL No:

Product Description

Catalog Number:
AG000C8D
Chemical Name:
Glycine, L-tyrosyl-L-phenylalanyl-
CAS Number:
116331-70-5
Molecular Formula:
C20H23N3O5
Molecular Weight:
385.4137
IUPAC Name:
2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenylpropanoyl]amino]acetic acid
InChI:
InChI=1S/C20H23N3O5/c21-16(10-14-6-8-15(24)9-7-14)19(27)23-17(20(28)22-12-18(25)26)11-13-4-2-1-3-5-13/h1-9,16-17,24H,10-12,21H2,(H,22,28)(H,23,27)(H,25,26)
InChI Key:
OKDNSNWJEXAMSU-UHFFFAOYSA-N
SMILES:
OC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(cc1)O)N

Properties

Complexity:
528  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.164g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
385.42g/mol
Monoisotopic Mass:
385.164g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9  

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