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Substance Name: Glutamic acid, N-(p-(((2,4-diamino-7-pteridinyl)methyl)methylamino)benzoyl)-, D-
RN: 65118-41-4
InChIKey: UUVPYTIBUIBXTJ-CYBMUJFWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N8-O5

Molecular Weight

  • 454.4448
 
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Names and Synonyms

Synonyms

  • N-(4-(((2,4-Diamino-7-pteridinyl)methyl)methylamino)benzoyl)-D-glutamic acid
  • N-(p-(((2,4-Diamino-7-pteridinyl)methyl)methylamino)benzoyl)-D-glutamic acid
  • p-((2,4-Diamino-7-pteridinyl)methyl-N(sup 10)-methyl)aminobenzoyl D-glutamic acid

Systematic Names

  • D-Glutamic acid, N-(4-(((2,4-diamino-7-pteridinyl)methyl)methylamino)benzoyl)-
  • Glutamic acid, N-(p-(((2,4-diamino-7-pteridinyl)methyl)methylamino)benzoyl)-, D-

Registry Numbers

CAS Registry Number

  • 65118-41-4

System Generated Number

  • 0065118414

Structure Descriptors

InChI

1S/C20H22N8O5/c1-28(9-11-8-23-15-16(21)26-20(22)27-17(15)24-11)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,24,26,27)/t13-/m1/s1

InChIKey

UUVPYTIBUIBXTJ-CYBMUJFWSA-N

Smiles

CN(Cc1cnc2c(nc(nc2n1)N)N)c3ccc(cc3)C(=O)N[C@H](CCC(=O)O)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 unreported 482mg/kg (482mg/kg)   Neoplasma. Vol. 29, Pg. 43, 1982.