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Substance Name: Levomefolate calcium pentahydrate
RN: 419563-18-1
UNII: JEC017DJGT
InChIKey: NVLUUBHWPOLECI-BWDMFOMUSA-L

Molecular Formula

  • C20-H23-N7-O6.Ca.5H2-O

Molecular Weight

  • 587.5967
 
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Names and Synonyms

Name of Substance

  • Levomefolate calcium pentahydrate

Synonyms

  • L-Glutamic acid, N-(4-((((6S)-2-amino-1,4,5,6,7,8-hexahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, calcium salt (1:1), pentahydrate
  • Levomefolate calcium pentahydrate
  • UNII-JEC017DJGT

Registry Numbers

CAS Registry Number

  • 419563-18-1

FDA UNII

  • JEC017DJGT

System Generated Number

  • 0419563181

Structure Descriptors

InChI

1S/C20H25N7O6.Ca.5H2O/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);;5*1H2/q;+2;;;;;/p-2/t12-,13-;;;;;;/m0....../s1

InChIKey

NVLUUBHWPOLECI-BWDMFOMUSA-L

Smiles

CN1c2c(nc(nc2O)N)NC[C@@H]1CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].O.O.O.O.O.[Ca+2]