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Substance Name: a-Denopterin dihydrate
RN: 25442-98-2
UNII: 2UQT19E1VZ
InChIKey: OVSAHNHYPVHZGQ-JQRWPJOOSA-N

Molecular Formula

  • C21-H24-N8-O5.2H2-O

Molecular Weight

  • 504.5012
 
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Names and Synonyms

Name of Substance

  • a-Denopterin dihydrate

Synonyms

  • a-Denopterin dihydrate
  • a-Denopterin dihydrate [MI]
  • Glutamic acid, N-(p-((1-(2,4-diamino-6-pteridinyl)ethyl)methylamino)benzoyl)-, dihydrate, L-
  • UNII-2UQT19E1VZ

Registry Numbers

CAS Registry Number

  • 25442-98-2

FDA UNII

  • 2UQT19E1VZ

System Generated Number

  • 0025442982

Structure Descriptors

InChI

1S/C21H24N8O5.2H2O/c1-10(14-9-24-18-16(25-14)17(22)27-21(23)28-18)29(2)12-5-3-11(4-6-12)19(32)26-13(20(33)34)7-8-15(30)31;;/h3-6,9-10,13H,7-8H2,1-2H3,(H,26,32)(H,30,31)(H,33,34)(H4,22,23,24,27,28);2*1H2/t10?,13-;;/m0../s1

InChIKey

OVSAHNHYPVHZGQ-JQRWPJOOSA-N

Smiles

CC(c1cnc2c(n1)c(nc(n2)N)N)N(C)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O.O.O