| PDB CCD ID: | 11H |
| Number of entries in BioLiP: | 3 |
| Chemical formula: | C14 H8 O8 S2 |
| InChI: | InChI=1S/C14H8O8S2/c15-13-9-3-1-7(23(17,18)19)5-11(9)14(16)10-4-2-8(6-12(10)13)24(20,21)22/h1-6H,(H,17,18,19)(H,20,21,22) |
| InChIKey: | MSSUFHMGCXOVBZ-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | O=S(=O)(O)c3ccc2C(=O)c1c(ccc(c1)S(=O)(=O)O)C(=O)c2c3 | | OpenEye OEToolkits 1.7.6 | c1cc2c(cc1S(=O)(=O)O)C(=O)c3ccc(cc3C2=O)S(=O)(=O)O | | CACTVS 3.370 | O[S](=O)(=O)c1ccc2C(=O)c3cc(ccc3C(=O)c2c1)[S](O)(=O)=O |
|
| Name: | 9,10-dioxo-9,10-dihydroanthracene-2,6-disulfonic acid |
| ChEMBL: | CHEMBL3747842 |
| ZINC: | ZINC000003964228 |
umich.edu