Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C29H24O3/c30-25-10-6-20(7-11-25)15-24-18-27-23(14-19-4-2-1-3-5-19)16-22(17-28(27)29(24)32)21-8-12-26(31)13-9-21/h1-13,16-17,24,30-31H,14-15,18H2/t24-/m0/s1 |
InChIKey | InChI | 1.03 | BBBVODRPSLPZKR-DEOSSOPVSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(C[C@H]2Cc3c(Cc4ccccc4)cc(cc3C2=O)c5ccc(O)cc5)cc1 |
SMILES | CACTVS | 3.385 | Oc1ccc(C[CH]2Cc3c(Cc4ccccc4)cc(cc3C2=O)c5ccc(O)cc5)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Cc2cc(cc3c2C[C@@H](C3=O)Cc4ccc(cc4)O)c5ccc(cc5)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Cc2cc(cc3c2CC(C3=O)Cc4ccc(cc4)O)c5ccc(cc5)O |