Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc2c1c(cccc1)c(c(c2)CC)CNC(=O)c4c3OC5=CC(O)=C(C(=O)C5(c3c(O)cc4OC)C)C(=O)C |
InChI | InChI | 1.03 | InChI=1S/C30H26FNO7/c1-5-15-10-19(31)17-9-7-6-8-16(17)18(15)13-32-29(37)25-22(38-4)11-21(35)26-27(25)39-23-12-20(34)24(14(2)33)28(36)30(23,26)3/h6-12,34-35H,5,13H2,1-4H3,(H,32,37)/t30-/m1/s1 |
InChIKey | InChI | 1.03 | FSXXQAXUJKNDPO-SSEXGKCCSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CCc1cc(F)c2ccccc2c1CNC(=O)c3c(OC)cc(O)c4c3OC5=CC(=C(C(C)=O)C(=O)[C@@]45C)O |
SMILES | CACTVS | 3.370 | CCc1cc(F)c2ccccc2c1CNC(=O)c3c(OC)cc(O)c4c3OC5=CC(=C(C(C)=O)C(=O)[C]45C)O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCc1cc(c2ccccc2c1CNC(=O)c3c(cc(c4c3OC5=CC(=C(C(=O)[C@@]45C)C(=O)C)O)O)OC)F |
SMILES | OpenEye OEToolkits | 1.7.6 | CCc1cc(c2ccccc2c1CNC(=O)c3c(cc(c4c3OC5=CC(=C(C(=O)C45C)C(=O)C)O)O)OC)F |