2.0 2012-05-31 13:59:39 -0600 2015-09-13 12:56:13 -0600 ECMDB03540 M2MDB000511 3'-AMP 3'-AMP is also known as Adenylic acid. It is an Adenine nucleotide containing one phosphate group esterified to the sugar moiety in the 3'-position. 3'-Adenosine monophosphate 3'-Adenosine monophosphoric acid 3'-Adenylate 3'-Adenylic acid 3'-AMP Adenosine 3'-monophosphate Adenosine 3'-monophosphoric acid Adenosine 3'-phosphate Adenosine 3'-phosphoric acid Adenosine-3'-monophosphate Adenosine-3'-monophosphorate Adenosine-3'-monophosphoric acid Adenosine-3'-phosphate Adenosine-3'-phosphoric acid AMP 3'-Phosphate AMP 3'-Phosphoric acid Synadenylate Synadenylic acid Yeast adenylate Yeast adenylic acid C10H14N5O7P 347.2212 347.063084339 {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid adenosine-3'-phosphate 84-21-9 NC1=C2N=CN([C@@H]3O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H]3O)C2=NC=N1 InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 LNQVTSROQXJCDD-KQYNXXCUSA-N Solid Extra-organism Periplasm logp -3.14 ALOGPS logs -2.00 ALOGPS solubility 3.48e+00 g/l ALOGPS melting_point 197 oC logp -4.8 ChemAxon pka_strongest_acidic 0.87 ChemAxon pka_strongest_basic 4.94 ChemAxon iupac {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid ChemAxon average_mass 347.2212 ChemAxon mono_mass 347.063084339 ChemAxon smiles NC1=C2N=CN([C@@H]3O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H]3O)C2=NC=N1 ChemAxon formula C10H14N5O7P ChemAxon inchi InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 ChemAxon inchikey LNQVTSROQXJCDD-KQYNXXCUSA-N ChemAxon polar_surface_area 186.07 ChemAxon refractivity 74.07 ChemAxon polarizability 29.67 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 10 ChemAxon donor_count 5 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Purine metabolism ec00230 Specdb::CMs 9310 Specdb::CMs 32126 Specdb::CMs 38625 Specdb::CMs 99816 Specdb::CMs 159438 Specdb::NmrOneD 149600 Specdb::NmrOneD 149601 Specdb::NmrOneD 149602 Specdb::NmrOneD 149603 Specdb::NmrOneD 149604 Specdb::NmrOneD 149605 Specdb::NmrOneD 149606 Specdb::NmrOneD 149607 Specdb::NmrOneD 149608 Specdb::NmrOneD 149609 Specdb::NmrOneD 149610 Specdb::NmrOneD 149611 Specdb::NmrOneD 149612 Specdb::NmrOneD 149613 Specdb::NmrOneD 149614 Specdb::NmrOneD 149615 Specdb::NmrOneD 149616 Specdb::NmrOneD 149617 Specdb::NmrOneD 149618 Specdb::NmrOneD 149619 Specdb::MsMs 25916 Specdb::MsMs 25917 Specdb::MsMs 25918 Specdb::MsMs 32474 Specdb::MsMs 32475 Specdb::MsMs 32476 Specdb::MsMs 438614 Specdb::MsMs 439269 Specdb::MsMs 447305 Specdb::MsMs 448209 Specdb::MsMs 2226923 Specdb::MsMs 2227770 Specdb::MsMs 2229359 Specdb::MsMs 2230116 Specdb::MsMs 2728963 Specdb::MsMs 2728964 Specdb::MsMs 2728965 Specdb::MsMs 2979809 Specdb::MsMs 2979810 Specdb::MsMs 2979811 HMDB03540 41211 37610 C01367 28931 CPD-3706 3AM 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 Kanehisa, M., Goto, S., Sato, Y., Furumichi, M., Tanabe, M. (2012). "KEGG for integration and interpretation of large-scale molecular data sets." Nucleic Acids Res 40:D109-D114. 22080510 http://hmdb.ca/system/metabolites/msds/000/003/121/original/HMDB03540.pdf?1358461316 2',3'-cyclic-nucleotide 2'-phosphodiesterase/3'-nucleotidase P08331 CPDB_ECOLI cpdB http://ecmdb.ca/proteins/P08331.xml Outer membrane protein N P77747 OMPN_ECOLI ompN http://ecmdb.ca/proteins/P77747.xml Outer membrane pore protein E P02932 PHOE_ECOLI phoE http://ecmdb.ca/proteins/P02932.xml Outer membrane protein F P02931 OMPF_ECOLI ompF http://ecmdb.ca/proteins/P02931.xml Outer membrane protein C P06996 OMPC_ECOLI ompC http://ecmdb.ca/proteins/P06996.xml 3'-AMP + Water > Adenosine + Phosphate Adenosine 2',3'-cyclic phosphate + Water > 3'-AMP + Hydrogen ion R03537 Adenosine 2',3'-cyclic phosphate + Water <> 3'-AMP R03537