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Substance Name: Methotrexate-alpha glutamate
RN: 71074-49-2
InChIKey: GCHKEUJNMCBNBS-UHFFFAOYSA-N

Molecular Formula

  • C25-H29-N9-O8

Molecular Weight

  • 583.5591
 
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Names and Synonyms

Name of Substance

  • Methotrexate-alpha glutamate

Synonym

  • Meapa-glu-glu

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 71074-49-2

System Generated Number

  • 0071074492

Structure Descriptors

InChI

1S/C25H29N9O8/c1-34(11-13-10-28-21-19(29-13)20(26)32-25(27)33-21)14-4-2-12(3-5-14)22(39)30-15(6-8-17(35)36)23(40)31-16(24(41)42)7-9-18(37)38/h2-5,10,15-16H,6-9,11H2,1H3,(H,30,39)(H,31,40)(H,35,36)(H,37,38)(H,41,42)(H4,26,27,28,32,33)

InChIKey

GCHKEUJNMCBNBS-UHFFFAOYSA-N

Smiles

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