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Substance Name: 2-Desamino-5,8-dideazafolic acid
RN: 106585-70-0
InChIKey: CSROEJXVRAZBAD-KRWDZBQOSA-N

Molecular Formula

  • C21-H20-N4-O6

Molecular Weight

  • 424.411
 
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Names and Synonyms

Name of Substance

  • 2-Desamino-5,8-dideazafolic acid

Systematic Name

  • L-Glutamic acid, N-(4-(((3,4-dihydro-4-oxo-6-quinazolinyl)methyl)amino)benzoyl)-

Registry Numbers

CAS Registry Number

  • 106585-70-0

System Generated Number

  • 0106585700

Structure Descriptors

InChI

1S/C21H20N4O6/c26-18(27)8-7-17(21(30)31)25-19(28)13-2-4-14(5-3-13)22-10-12-1-6-16-15(9-12)20(29)24-11-23-16/h1-6,9,11,17,22H,7-8,10H2,(H,25,28)(H,26,27)(H,30,31)(H,23,24,29)/t17-/m0/s1

InChIKey

CSROEJXVRAZBAD-KRWDZBQOSA-N

Smiles

C([C@@H](NC(c1ccc(cc1)NCc1cc2c([nH]cnc2cc1)=O)=O)CCC(=O)O)(=O)O