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Substance Name: Isohomoaminopterin
RN: 39271-61-9
InChIKey: DSQDEAFTKORRSV-ZDUSSCGKSA-N

Molecular Weight

  • 454.4448
 
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Names and Synonyms

Name of Substance

  • Isohomoaminopterin

Systematic Name

  • N-(4-((((2,4-Diamino-6-pteridinyl)methyl)amino)methyl)benzoyl)-L-glutamic acid

Registry Numbers

CAS Registry Number

  • 39271-61-9

System Generated Number

  • 0039271619

Structure Descriptors

InChI

1S/C20H22N8O5/c21-16-15-17(28-20(22)27-16)24-9-12(25-15)8-23-7-10-1-3-11(4-2-10)18(31)26-13(19(32)33)5-6-14(29)30/h1-4,9,13,23H,5-8H2,(H,26,31)(H,29,30)(H,32,33)(H4,21,22,24,27,28)/t13-/m0/s1

InChIKey

DSQDEAFTKORRSV-ZDUSSCGKSA-N

Smiles

c1cc(ccc1CNCc2cnc3c(n2)c(nc(n3)N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O