U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H16F3N3O6
Molecular Weight 487.3848
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FULACIMSTAT

SMILES

CN1C(=O)OC2=CC(=CC=C12)N3C=C(C(O)=O)C(=O)N([C@@H]4CCC5=C(C=CC=C45)C(F)(F)F)C3=O

InChI

InChIKey=JDARDSVOVYVQST-MRXNPFEDSA-N
InChI=1S/C23H16F3N3O6/c1-27-17-7-5-11(9-18(17)35-22(27)34)28-10-14(20(31)32)19(30)29(21(28)33)16-8-6-12-13(16)3-2-4-15(12)23(24,25)26/h2-5,7,9-10,16H,6,8H2,1H3,(H,31,32)/t16-/m1/s1

HIDE SMILES / InChI

Approval Year