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Substance Name: 2-((4-(((2,4-Diaminopteridin-6-yl)methyl)methylamino)phenyl)carbonylamino)-4-sulfobutanoic acid
RN: 90081-15-5
InChIKey: AZBMALLCUFVCHQ-UHFFFAOYSA-N

Molecular Formula

  • C19-H22-N8-O6-S

Molecular Weight

  • 490.4988
 
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Names and Synonyms

  • 2-((4-(((2,4-Diaminopteridin-6-yl)methyl)methylamino)phenyl)carbonylamino)-4-sulfobutanoic acid

Registry Numbers

CAS Registry Number

  • 90081-15-5

System Generated Number

  • 0090081155

Structure Descriptors

InChI

1S/C19H22N8O6S/c1-27(9-11-8-22-16-14(23-11)15(20)25-19(21)26-16)12-4-2-10(3-5-12)17(28)24-13(18(29)30)6-7-34(31,32)33/h2-5,8,13H,6-7,9H2,1H3,(H,24,28)(H,29,30)(H,31,32,33)(H4,20,21,22,25,26)

InChIKey

AZBMALLCUFVCHQ-UHFFFAOYSA-N

Smiles

CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)NC(CCS(=O)(=O)O)C(=O)O