PDB CCD ID: | HCT |
Number of entries in BioLiP: | 6 |
Chemical formula: | C7 H10 O6 |
InChI: | InChI=1S/C7H10O6/c8-5(9)2-1-4(7(12)13)3-6(10)11/h4H,1-3H2,(H,8,9)(H,10,11)(H,12,13)/t4-/m1/s1 |
InChIKey: | LOGBRYZYTBQBTB-SCSAIBSYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.341 | OC(=O)CC[C@H](CC(O)=O)C(O)=O | OpenEye OEToolkits 1.5.0 | C(CC(=O)O)[C@H](CC(=O)O)C(=O)O | CACTVS 3.341 | OC(=O)CC[CH](CC(O)=O)C(O)=O | OpenEye OEToolkits 1.5.0 | C(CC(=O)O)C(CC(=O)O)C(=O)O | ACDLabs 10.04 | O=C(O)CCC(C(=O)O)CC(=O)O |
|
Name: | (2R)-butane-1,2,4-tricarboxylic acid |
ZINC: | ZINC000001586744 |