2.0 2012-05-31 14:48:48 -0600 2015-06-03 17:20:09 -0600 ECMDB20521 M2MDB001329 N-Ethylsuccinimide N-ethylsuccinimide is a member of the chemical class known as Pyrrolidones. These are compounds containing a pyrrolidine ring which bears a ketone. It is a product of the reduction of of N-ethylmaleimide (NEM) by N-ethylmaleimide reductase. 1-Ethyl-2,5-pyrrolidinedione 1-Ethyl-Pyrrolidine-2,5-Dione 1-Ethylpyrrolidine-2,5-dione Ethylsuccinimide N-Ethyl-Succinimide NEN Succinimide, N-ethyl C6H9NO2 127.1412 127.063328537 1-ethylpyrrolidine-2,5-dione 1-ethyl-pyrrolidine-2,5-dione 2314-78-5 CCN1C(=O)CCC1=O InChI=1S/C6H9NO2/c1-2-7-5(8)3-4-6(7)9/h2-4H2,1H3 GHAZCVNUKKZTLG-UHFFFAOYSA-N Solid Cytoplasm Periplasm logp -0.09 ALOGPS logs 0.68 ALOGPS solubility 6.15e+02 g/l ALOGPS melting_point 26 oC logp -0.41 ChemAxon pka_strongest_basic -6.7 ChemAxon iupac 1-ethylpyrrolidine-2,5-dione ChemAxon average_mass 127.1412 ChemAxon mono_mass 127.063328537 ChemAxon smiles CCN1C(=O)CCC1=O ChemAxon formula C6H9NO2 ChemAxon inchi InChI=1S/C6H9NO2/c1-2-7-5(8)3-4-6(7)9/h2-4H2,1H3 ChemAxon inchikey GHAZCVNUKKZTLG-UHFFFAOYSA-N ChemAxon polar_surface_area 37.38 ChemAxon refractivity 31.93 ChemAxon polarizability 12.71 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 277678 Specdb::NmrOneD 277679 Specdb::NmrOneD 277680 Specdb::NmrOneD 277681 Specdb::NmrOneD 277682 Specdb::NmrOneD 277683 Specdb::NmrOneD 277684 Specdb::NmrOneD 277685 Specdb::NmrOneD 277686 Specdb::NmrOneD 277687 Specdb::NmrOneD 277688 Specdb::NmrOneD 277689 Specdb::NmrOneD 277690 Specdb::NmrOneD 277691 Specdb::NmrOneD 277692 Specdb::NmrOneD 277693 Specdb::NmrOneD 277694 Specdb::NmrOneD 277695 Specdb::NmrOneD 277696 Specdb::NmrOneD 277697 Specdb::MsMs 29600 Specdb::MsMs 29601 Specdb::MsMs 29602 Specdb::MsMs 36158 Specdb::MsMs 36159 Specdb::MsMs 36160 16842 15961 44348 CPD0-903 NEN Keseler, I. M., Collado-Vides, J., Santos-Zavaleta, A., Peralta-Gil, M., Gama-Castro, S., Muniz-Rascado, L., Bonavides-Martinez, C., Paley, S., Krummenacker, M., Altman, T., Kaipa, P., Spaulding, A., Pacheco, J., Latendresse, M., Fulcher, C., Sarker, M., Shearer, A. G., Mackie, A., Paulsen, I., Gunsalus, R. P., Karp, P. D. (2011). "EcoCyc: a comprehensive database of Escherichia coli biology." Nucleic Acids Res 39:D583-D590. 21097882 N-ethylmaleimide reductase, FMN-linked (EC:1.-.-.-) P77258 nemA http://ecmdb.ca/proteins/P77258.xml Hydrogen ion + <i>N</i>-ethylmaleimide N-Ethylsuccinimide RXN0-5101