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132149-57-6

132149-57-6 | L-Tyrosine, 1-[(1,1-dimethylethoxy)carbonyl]-L-prolyl- (9CI)

CAS No: 132149-57-6 Catalog No: AG0010A0 MDL No:

Product Description

Catalog Number:
AG0010A0
Chemical Name:
L-Tyrosine, 1-[(1,1-dimethylethoxy)carbonyl]-L-prolyl- (9CI)
CAS Number:
132149-57-6
Molecular Formula:
C19H26N2O6
Molecular Weight:
378.4195
IUPAC Name:
(2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carbonyl]amino]propanoic acid
InChI:
InChI=1S/C19H26N2O6/c1-19(2,3)27-18(26)21-10-4-5-15(21)16(23)20-14(17(24)25)11-12-6-8-13(22)9-7-12/h6-9,14-15,22H,4-5,10-11H2,1-3H3,(H,20,23)(H,24,25)/t14-,15-/m0/s1
InChI Key:
QMCSDGUSXNPAMC-GJZGRUSLSA-N
SMILES:
OC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C

Properties

Complexity:
551  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
378.179g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
378.425g/mol
Monoisotopic Mass:
378.179g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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