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Substance Name: 5-Methyltetrahydrofolate barium salt
RN: 68703-91-3
InChIKey: CJDBLCUPSKRHFJ-UHFFFAOYSA-L

Molecular Formula

  • C20-H25-N7-O6.Ba

Molecular Weight

  • 594.775
 
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Names and Synonyms

Results Name

  • 5-Methyltetrahydrofolate barium salt

Synonym

  • 5-Methyltetrahydrofolate barium salt

Systematic Name

  • DL-Glutamic acid, N-(4-(((2-amino-1,4,5,6,7,8-hexahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, barium salt (1:1)

Registry Numbers

CAS Registry Number

  • 68703-91-3

System Generated Number

  • 0068703913

Molecular Formulas

Molecular Formula

  • C20-H25-N7-O6.Ba

Molecular Formula Fragments

  • Ba
  • C20-H25-N7-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C20H25N7O6.Ba/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29;/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31);/q;+2/p-2

InChIKey

CJDBLCUPSKRHFJ-UHFFFAOYSA-L

Smiles

[Ba+2].C([C@@H](NC(c1ccc(cc1)NC[C@@H]1N(c2c(nc([nH]c2NC1)N)=O)C)=O)CCC(=O)[O-])(=O)[O-]