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178921-93-2 | L-Tyrosine, L-prolyl-L-prolyl-L-prolyl-L-prolyl-
CAS No: 178921-93-2 Catalog No: AG0026HY MDL No:
Product Description
Catalog Number:
AG0026HY
Chemical Name:
L-Tyrosine, L-prolyl-L-prolyl-L-prolyl-L-prolyl-
CAS Number:
178921-93-2
Molecular Formula:
C29H39N5O7
Molecular Weight:
569.6493
IUPAC Name:
(2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]propanoic acid
InChI:
InChI=1S/C29H39N5O7/c35-19-11-9-18(10-12-19)17-21(29(40)41)31-25(36)22-6-2-14-32(22)27(38)24-8-4-16-34(24)28(39)23-7-3-15-33(23)26(37)20-5-1-13-30-20/h9-12,20-24,30,35H,1-8,13-17H2,(H,31,36)(H,40,41)/t20-,21-,22-,23-,24-/m0/s1
InChI Key:
JOVFWYQFKWZDAO-LSBAASHUSA-N
SMILES:
OC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1
Properties
Complexity:
1020
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
569.285g/mol
Formal Charge:
0
Heavy Atom Count:
41
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
569.659g/mol
Monoisotopic Mass:
569.285g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
160A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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