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Substance Name: 10-Propargyl-5-methyl-5-deazaaminopterin analog of folic acid
RN: 135423-85-7
InChIKey: NXZWILPVWKKBOG-KRWDZBQOSA-N

Molecular Formula

  • C24-H25-N7-O5

Molecular Weight

  • 491.505
 
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Names and Synonyms

Name of Substance

  • 10-Propargyl-5-methyl-5-deazaaminopterin analog of folic acid

Synonym

  • 10-Pmdap

Systematic Name

  • L-Glutamic acid, N-(4-(((2,4-diamino-5-methylpyrido(2,3-d)pyrimidin-6-yl)methyl)-2-propynylamino)benzoyl)-

Registry Numbers

CAS Registry Number

  • 135423-85-7

System Generated Number

  • 0135423857

Structure Descriptors

InChI

1S/C24H25N7O5/c1-3-10-31(12-15-11-27-21-19(13(15)2)20(25)29-24(26)30-21)16-6-4-14(5-7-16)22(34)28-17(23(35)36)8-9-18(32)33/h1,4-7,11,17H,8-10,12H2,2H3,(H,28,34)(H,32,33)(H,35,36)(H4,25,26,27,29,30)/t17-/m0/s1

InChIKey

NXZWILPVWKKBOG-KRWDZBQOSA-N

Smiles

C([C@@H](NC(c1ccc(cc1)N(CC#C)Cc1c(c2c(nc(nc2N)N)nc1)C)=O)CCC(=O)O)(=O)O