2-({4-[1-(2,4-Diaminopteridin-3-ium-6-yl)-4-pentyn-2-yl]benzoyl}amino)pentanedioate

SMILES:

[O-]C(=O)C(NC(=O)c1ccc(cc1)C(CC#C)Cc2nc3c([nH+]c(nc3nc2)N)N)CCC([O-])=O CopyCopied

Std. InChI:

InChI=1S/C23H23N7O5/c1-2-3-14(10-15-11-26-20-18(27-15)19(24)29-23(25)30-20)12-4-6-13(7-5-12)21(33)28-16(22(34)35)8-9-17(31)32/h1,4-7,11,14,16H,3,8-10H2,(H,28,33)(H,31,32)(H,34,35)(H4,24,25,26,29,30)/p-1 CopyCopied

Std. InChIKey:

OGSBUKJUDHAQEA-UHFFFAOYSA-M CopyCopied

CSID:21210531, http://www.chemspider.com/Chemical-Structure.21210531.html (accessed 19:24, May 18, 2013) CopyCopied