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Substance Name: Glutamic acid, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)-2-methoxybenzoyl)-, L-
RN: 82144-25-0
InChIKey: ODMPDCRSDDHRHW-ZDUSSCGKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N8-O6

Molecular Weight

  • 484.4706
 
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Names and Synonyms

Synonym

  • N-(4-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)-2-methoxybenzoyl)-L-glutamic acid

Systematic Names

  • Glutamic acid, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)-2-methoxybenzoyl)-, L-
  • L-Glutamic acid, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)-2-methoxybenzoyl)-

Registry Numbers

CAS Registry Number

  • 82144-25-0

System Generated Number

  • 0082144250

Structure Descriptors

InChI

1S/C21H24N8O6/c1-29(9-10-8-24-18-16(25-10)17(22)27-21(23)28-18)11-3-4-12(14(7-11)35-2)19(32)26-13(20(33)34)5-6-15(30)31/h3-4,7-8,13H,5-6,9H2,1-2H3,(H,26,32)(H,30,31)(H,33,34)(H4,22,23,24,27,28)/t13-/m0/s1

InChIKey

ODMPDCRSDDHRHW-ZDUSSCGKSA-N

Smiles

CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(c(c3)OC)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 2161mg/kg (2161mg/kg)   Neoplasma. Vol. 29, Pg. 43, 1982.