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920010-39-5

920010-39-5 | Glycine, L-arginyl-L-tyrosyl-L-asparaginyl-L-methionyl-

CAS No: 920010-39-5 Catalog No: AG006G65 MDL No:

Product Description

Catalog Number:
AG006G65
Chemical Name:
Glycine, L-arginyl-L-tyrosyl-L-asparaginyl-L-methionyl-
CAS Number:
920010-39-5
Molecular Formula:
C26H41N9O8S
Molecular Weight:
639.7242
IUPAC Name:
2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxobutanoyl]amino]-4-methylsulfanylbutanoyl]amino]acetic acid
InChI:
InChI=1S/C26H41N9O8S/c1-44-10-8-17(23(41)32-13-21(38)39)33-25(43)19(12-20(28)37)35-24(42)18(11-14-4-6-15(36)7-5-14)34-22(40)16(27)3-2-9-31-26(29)30/h4-7,16-19,36H,2-3,8-13,27H2,1H3,(H2,28,37)(H,32,41)(H,33,43)(H,34,40)(H,35,42)(H,38,39)(H4,29,30,31)/t16-,17-,18-,19-/m0/s1
InChI Key:
DIZAMICCWTTWMQ-VJANTYMQSA-N
SMILES:
CSCC[C@@H](C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)N)Cc1ccc(cc1)O)CC(=O)N

Properties

Complexity:
1020  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
639.28g/mol
Formal Charge:
0
Heavy Atom Count:
44  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
10  
Isotope Atom Count:
0
Molecular Weight:
639.729g/mol
Monoisotopic Mass:
639.28g/mol
Rotatable Bond Count:
20  
Topological Polar Surface Area:
333A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.3  

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