| PDB CCD ID: | IVO |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C8 H10 N2 O5 |
| InChI: | InChI=1S/C8H10N2O5/c11-4-3(8(14)15)10-2-1-9-7(10)6(13)5(4)12/h1-6,11-13H,(H,14,15)/t3-,4+,5-,6+/m0/s1 |
| InChIKey: | YLDYISMFCJKSRS-BGPJRJDNSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | O[CH]1[CH](O)[CH](n2ccnc2[CH]1O)C(O)=O | | OpenEye OEToolkits 2.0.7 | c1cn2c(n1)[C@@H]([C@H]([C@@H]([C@H]2C(=O)O)O)O)O | | CACTVS 3.385 | O[C@H]1[C@H](O)[C@H](n2ccnc2[C@@H]1O)C(O)=O | | OpenEye OEToolkits 2.0.7 | c1cn2c(n1)C(C(C(C2C(=O)O)O)O)O |
|
| Name: | (5~{S},6~{R},7~{S},8~{S})-6,7,8-tris(oxidanyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-5-carboxylic acid |
| ChEMBL: | CHEMBL4650593 |
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