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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H22N8O7
Molecular Weight 486.4381
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge -2

SHOW SMILES / InChI
Structure of N-nitroso-levomefolic acid-2

SMILES

CN1[C@@H](CN(N=O)C2=CC=C(C=C2)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)CNC3=C1C(=O)N=C(N)N3

InChI

InChIKey=ZPAYHPPCDHPLNT-OLZOCXBDSA-L
InChI=1S/C20H24N8O7/c1-27-12(8-22-16-15(27)18(32)25-20(21)24-16)9-28(26-35)11-4-2-10(3-5-11)17(31)23-13(19(33)34)6-7-14(29)30/h2-5,12-13H,6-9H2,1H3,(H,23,31)(H,29,30)(H,33,34)(H4,21,22,24,25,32)/p-2/t12-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H22N8O7
Molecular Weight 486.4381
Charge -2
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
8QG4RX7WX6
Record Status Validated (UNII)
Record Version