| PDB CCD ID: | UR5 |
| Number of entries in BioLiP: | 3 |
| Chemical formula: | C6 H8 N2 O4 |
| InChI: | InChI=1S/C6H8N2O4/c9-5-2-1-7-3(6(10)11)4(2)12-8-5/h2-4,7H,1H2,(H,8,9)(H,10,11)/t2-,3-,4-/m0/s1 |
| InChIKey: | IOOKKDXVJPSSSC-HZLVTQRSSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | C1C2C(C(N1)C(=O)O)ONC2=O | | CACTVS 3.385 | OC(=O)[C@H]1NC[C@H]2[C@@H]1ONC2=O | | OpenEye OEToolkits 2.0.7 | C1[C@H]2[C@@H]([C@H](N1)C(=O)O)ONC2=O | | CACTVS 3.385 | OC(=O)[CH]1NC[CH]2[CH]1ONC2=O |
|
| Name: | (+)-3-Hydroxy-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]isoxazole-6-carboxylic acid;
(3~{a}~{S},6~{S},6~{a}~{S})-3-oxidanylidene-4,5,6,6~{a}-tetrahydro-3~{a}~{H}-pyrrolo[3,4-d][1,2]oxazole-6-carboxylic acid |
| ChEMBL: | CHEMBL133337 |
| ZINC: | ZINC000007992849 |
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