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Home > Nitro Compounds > 6803-19-6
6803-19-6 | S-(P-NITROBENZYL)GLUTATHIONE
CAS No: 6803-19-6 Catalog No: AG00FBBS MDL No:
Product Description
Catalog Number:
AG00FBBS
Chemical Name:
S-(P-NITROBENZYL)GLUTATHIONE
CAS Number:
6803-19-6
IUPAC Name:
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
InChI:
InChI=1S/C17H22N4O8S/c18-12(17(26)27)5-6-14(22)20-13(16(25)19-7-15(23)24)9-30-8-10-1-3-11(4-2-10)21(28)29/h1-4,12-13H,5-9,18H2,(H,19,25)(H,20,22)(H,23,24)(H,26,27)/t12-,13-/m0/s1
InChI Key:
OAWORKDPTSAMBZ-STQMWFEESA-N
Properties
Complexity:
634
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
442.116g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
442.443g/mol
Monoisotopic Mass:
442.116g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
230A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.8
Literature
| Title | Journal |
|---|---|
| Site-directed mutagenesis of mouse glutathione transferase P1-1 unlocks masked cooperativity, introduces a novel mechanism for 'ping pong' kinetic behaviour, and provides further structural evidence for participation of a water molecule in proton abstraction from glutathione. | The FEBS journal 20110101 |
| Crystal structures of the yeast prion Ure2p functional region in complex with glutathione and related compounds. | Biochemistry 20011113 |
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