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Levomefolate Impurity 6

SZ CAT No SZ-L073014
CAS No NA
Mol.F. C20H21N7O7 : Ca
Mol.Wt. 471.4 : 40.1
Inv. Status Custom Synthesis


Chemical Name: Calcium (4-((((R)-2-amino-8-methyl-4,9-dioxo-6,7,8,9-tetrahydro-4H-pyrazino[1,2-a][1,3,5]triazin-7-yl)methyl)amino)benzoyl)-L-glutamate

Smiles: O=C(N[C@@H](CCC([O-])=O)C([O-])=O)C1=CC=C(C=C1)NC[C@H]2N(C)C(C(N3C2)=NC(N)=NC3=O)=O.[Ca+2]

Inchi: InChI=1S/C20H25N7O6.Ca/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/t12-,13?;/m1./s1