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88934-36-5

88934-36-5 | L-Glutamic acid, N-L-tyrosyl-, monohydrate

CAS No: 88934-36-5 Catalog No: AG004806 MDL No:

Product Description

Catalog Number:
AG004806
Chemical Name:
L-Glutamic acid, N-L-tyrosyl-, monohydrate
CAS Number:
88934-36-5
Molecular Formula:
C14H20N2O7
Molecular Weight:
328.3178
IUPAC Name:
2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]pentanedioic acid;hydrate
InChI:
InChI=1S/C14H18N2O6.H2O/c15-10(7-8-1-3-9(17)4-2-8)13(20)16-11(14(21)22)5-6-12(18)19;/h1-4,10-11,17H,5-7,15H2,(H,16,20)(H,18,19)(H,21,22);1H2
InChI Key:
GJYDGSZRGALYPC-UHFFFAOYSA-N
SMILES:
OC(=O)CC[C@@H](C(=O)O)NC(=O)[C@H](Cc1ccc(cc1)O)N.O

Properties

Complexity:
406  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.127g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
328.321g/mol
Monoisotopic Mass:
328.127g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0

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