Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C\C(=C/Cc3c2C(c1c(c(C\C=C(\C)C)c(O)cc1Oc2cc(O)c3OC)O)=O)C |
InChI | InChI | 1.03 | InChI=1S/C24H26O6/c1-12(2)6-8-14-16(25)10-19-21(22(14)27)23(28)20-15(9-7-13(3)4)24(29-5)17(26)11-18(20)30-19/h6-7,10-11,25-27H,8-9H2,1-5H3 |
InChIKey | InChI | 1.03 | GNRIZKKCNOBBMO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1c(O)cc2Oc3cc(O)c(CC=C(C)C)c(O)c3C(=O)c2c1CC=C(C)C |
SMILES | CACTVS | 3.385 | COc1c(O)cc2Oc3cc(O)c(CC=C(C)C)c(O)c3C(=O)c2c1CC=C(C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC(=CCc1c(cc2c(c1O)C(=O)c3c(cc(c(c3CC=C(C)C)OC)O)O2)O)C |
SMILES | OpenEye OEToolkits | 1.9.2 | CC(=CCc1c(cc2c(c1O)C(=O)c3c(cc(c(c3CC=C(C)C)OC)O)O2)O)C |