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Substance Name: Diazoketone methotrexate
RN: 82972-54-1
InChIKey: DUYMESGXUXXYQB-HNNXBMFYSA-N

Molecular Weight

  • 478.4708
 
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Names and Synonyms

Name of Substance

  • Diazoketone methotrexate

Synonyms

  • 4-Amino-4-deoxy-N-10-methylpteroyl-(6-diazo-5-oxo)norleucine
  • Methotrexate diazoketone analog

Systematic Name

  • L-Norleucine, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-6-diazo-5-oxo-

Registry Numbers

CAS Registry Number

  • 82972-54-1

System Generated Number

  • 0082972541

Structure Descriptors

InChI

1S/C21H22N10O4/c1-31(10-12-8-25-18-16(27-12)17(22)29-21(23)30-18)13-4-2-11(3-5-13)19(33)28-15(20(34)35)7-6-14(32)9-26-24/h2-5,8-9,15H,6-7,10H2,1H3,(H,28,33)(H,34,35)(H4,22,23,25,29,30)/t15-/m0/s1

InChIKey

DUYMESGXUXXYQB-HNNXBMFYSA-N

Smiles

CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)C=[N+]=[N-])C(=O)O