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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H20N4O3
Molecular Weight 280.3229
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LISOFYLLINE, (S)-

SMILES

C[C@H](O)CCCCN1C(=O)N(C)C2=C(N(C)C=N2)C1=O

InChI

InChIKey=NSMXQKNUPPXBRG-VIFPVBQESA-N
InChI=1S/C13H20N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8-9,18H,4-7H2,1-3H3/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H20N4O3
Molecular Weight 280.3229
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
N939YFB9KP
Record Status Validated (UNII)
Record Version