11-Oxahomoaminopterin

2-[[4-[2-(2,4-diaminopteridin-6-yl)ethoxy]benzoyl]amino]pentanedioic acid

Also Known As: 11-Oxahomoaminopterin|2-[[4-[2-(2,4-diaminopteridin-6-yl)ethoxy]benzoyl]amino]pentanedioic acid|n-{4-[2-(2,4-diaminopteridin-6-yl)ethoxy]benzoyl}glutamic acid|(2S)-2-[[4-[2-(2,4-diaminopteridin-6-yl)ethoxy]benzoyl]amino]pentanedioic acid|L-Glutamic acid, N-(4-(2-(2,4-diamino-6-pteridinyl)ethoxy)benzoyl)-|L-glutamic acid,n-[4-[2-(2,4-diamino-6-pteridinyl)ethoxy]benzoyl]-|2-{4-[2-(2,4-Diamino-pteridin-6-yl)-ethoxy]-benzoylamino}-pentanedioic acid

Molecular Formula	C20H21N7O6
Molecular Weight	455.15533 g/mol
LogP	0.25
Topological Polar Surface Area	216.53 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	10
Rotatable Bonds	10
Exact Mass	455.15533
Heavy Atoms	33
Complexity	1185.5

Chemical Identifiers

CAS Number	78520-72-6
SMILES	C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)OCCC2=CN=C3C(=N2)C(=NC(=N3)N)N