| PDB CCD ID: | XPI |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C19 H20 N2 O7 S |
| InChI: | InChI=1S/C19H20N2O7S/c1-25-15-10-18(27-3)17(26-2)8-13(15)16-9-14(19(22)28-16)21-11-4-6-12(7-5-11)29(20,23)24/h4-10,16,21H,1-3H3,(H2,20,23,24)/t16-/m1/s1 |
| InChIKey: | UWPJANIOFXYDOC-MRXNPFEDSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | COc1cc(OC)c(cc1OC)[C@@H]2OC(=O)C(=C2)Nc3ccc(cc3)[S](N)(=O)=O | | OpenEye OEToolkits 2.0.7 | COc1cc(c(cc1OC)OC)C2C=C(C(=O)O2)Nc3ccc(cc3)S(=O)(=O)N | | CACTVS 3.385 | COc1cc(OC)c(cc1OC)[CH]2OC(=O)C(=C2)Nc3ccc(cc3)[S](N)(=O)=O | | OpenEye OEToolkits 2.0.7 | COc1cc(c(cc1OC)OC)[C@H]2C=C(C(=O)O2)Nc3ccc(cc3)S(=O)(=O)N |
|
| Name: | 4-[[(2~{R})-5-oxidanylidene-2-(2,4,5-trimethoxyphenyl)-2~{H}-furan-4-yl]amino]benzenesulfonamide |
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