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7-(gamma-Glutamyl)-4-methylcoumarylamide

HCID 126296
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Basic information

CAS
3416-21-5
Standard SMILES
Cc1cc(=O)oc2cc(N[C@@H](CCC(N)=O)C(=O)O)ccc12
InChIKey
VGAZEIKWWKJEAG-NSHDSACASA-N
Molecular formula
C15H16N2O5
Average molar mass
304.3 g/mol
Monoisotopic mass
304.10592162

Overview

fluorogenic substrate for glutamyl transpeptidase when used with glycylglycine

Names & identifiers

Preferred name
7-(gamma-Glutamyl)-4-methylcoumarylamide
IUPAC
(2S)-5-amino-2-[(4-methyl-2-oxochromen-7-yl)amino]-5-oxopentanoic acid

Names & synonyms

7-(gamma-Glutamyl)-4-methylcoumarylamideL-Glutamine, N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-RefChem:105742Glu-amcgamma-Glutamyl-amc7-Gga-MC(2S)-5-amino-2-[(4-methyl-2-oxochromen-7-yl)amino]-5-oxopentanoic acidDTXSID40955702(2S)-2-azaniumyl-5-[(4-methyl-2-oxochromen-7-yl)amino]-5-oxopentanoate7-gamma-Glutamaylamiado-4-methylcoumarinL-gamma-Glutamyl-7-amino-4-methylcoumarin7-(gamma-L-Glutamyl)-4-methyl-coumarylamide
Show more names
5-Hydroxy-5-imino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-L-norvaline5-Hydroxy-5-imino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)norvaline

Database identifiers

CAS
3416-21-5、72669-53-5
PubChem CID
126296
DTXSID
DTXSID40955702

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
119 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
502

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Compound notes

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