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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H26FN6O6P
Molecular Weight 508.4399
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOBREPODACIN

SMILES

[H][C@@]1(CCCO1)C2=C3NC(NC(=O)NCC)=NC3=CC(C4=CN=C(N=C4)C(C)(C)OP(O)(O)=O)=C2F

InChI

InChIKey=COTQDURISRILOR-CQSZACIVSA-N
InChI=1S/C21H26FN6O6P/c1-4-23-20(29)28-19-26-13-8-12(16(22)15(17(13)27-19)14-6-5-7-33-14)11-9-24-18(25-10-11)21(2,3)34-35(30,31)32/h8-10,14H,4-7H2,1-3H3,(H2,30,31,32)(H3,23,26,27,28,29)/t14-/m1/s1

HIDE SMILES / InChI

Approval Year