| PDB CCD ID: | BG9 |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C12 H10 O4 |
| InChI: | InChI=1S/C12H10O4/c13-11(14)7-5-9-3-1-2-4-10(9)6-8-12(15)16/h1-8H,(H,13,14)(H,15,16)/b7-5+,8-6+ |
| InChIKey: | ZFCNOKDRWHSHNR-KQQUZDAGSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.6 | c1cc(c(cc1)/C=C/C(=O)O)/C=C/C(=O)O | | CACTVS 3.385 | OC(=O)/C=C/c1ccccc1/C=C/C(O)=O | | CACTVS 3.385 | OC(=O)C=Cc1ccccc1C=CC(O)=O | | OpenEye OEToolkits 2.0.6 | c1ccc(c(c1)C=CC(=O)O)C=CC(=O)O | | ACDLabs 12.01 | c1ccc(c(c1)[C@H]=[C@H]C(O)=O)C=[C@H]C(O)=O |
|
| Name: | (2E,2'E)-3,3'-(1,2-phenylene)di(prop-2-enoic acid) |
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