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Substance Name: 2-Aza-2-desamino-5,8-dideazafolic acid
RN: 140410-01-1
InChIKey: YKORUANEKZOBMT-INIZCTEOSA-N

Molecular Formula

  • C20-H19-N5-O6

Molecular Weight

  • 425.399
 
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Names and Synonyms

Name of Substance

  • 2-Aza-2-desamino-5,8-dideazafolic acid

Synonyms

  • ADDF
  • N-(4-(((1,4-Dihydro-4-oxo-1,2,3-benzotriazin-6-yl)methyl)amino)benzoyl)-L-glutamic acid
  • N-(4-(((3,4-Dihydro-4-oxo-1,2,3-benzotriazin-6-yl)methyl)amino)benzoyl)-L-glutamic acid

Systematic Name

  • L-Glutamic acid, N-(4-(((1,4-dihydro-4-oxo-1,2,3-benzotriazin-6-yl)methyl)amino)benzoyl)-

Registry Numbers

CAS Registry Number

  • 140410-01-1

System Generated Number

  • 0140410011

Structure Descriptors

InChI

1S/C20H19N5O6/c26-17(27)8-7-16(20(30)31)22-18(28)12-2-4-13(5-3-12)21-10-11-1-6-15-14(9-11)19(29)24-25-23-15/h1-6,9,16,21H,7-8,10H2,(H,22,28)(H,26,27)(H,30,31)(H,23,24,29)/t16-/m0/s1

InChIKey

YKORUANEKZOBMT-INIZCTEOSA-N

Smiles

C([C@@H](NC(c1ccc(cc1)NCc1cc2c(nn[nH]c2cc1)=O)=O)CCC(=O)O)(=O)O