Home Carboxys L-Tyrosine,N-(3-carboxy-1-oxopropyl)-

L-Tyrosine,N-(3-carboxy-1-oxopropyl)-

CAS No.:
374816-32-7
Catalog Number:
AG0079MS
Molecular Formula:
C13H15NO6
Molecular Weight:
281.2613
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Product Description
Catalog Number:
AG0079MS
Chemical Name:
L-Tyrosine,N-(3-carboxy-1-oxopropyl)-
CAS Number:
374816-32-7
Molecular Formula:
C13H15NO6
Molecular Weight:
281.2613
MDL Number:
MFCD18252486
IUPAC Name:
4-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-4-oxobutanoic acid
InChI:
InChI=1S/C13H15NO6/c15-9-3-1-8(2-4-9)7-10(13(19)20)14-11(16)5-6-12(17)18/h1-4,10,15H,5-7H2,(H,14,16)(H,17,18)(H,19,20)/t10-/m0/s1
InChI Key:
ZMLAEOWQOQIWJT-JTQLQIEISA-N
SMILES:
O=C(N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC(=O)O
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
281.09g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
281.264g/mol
Monoisotopic Mass:
281.09g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties