PDB CCD ID: | SU8 |
Number of entries in BioLiP: | 1 |
Chemical formula: | C8 H14 O4 |
InChI: | InChI=1S/C8H14O4/c1-2-3-4-6(8(11)12)5-7(9)10/h6H,2-5H2,1H3,(H,9,10)(H,11,12)/t6-/m1/s1 |
InChIKey: | WOPLHDNLGYOSPG-ZCFIWIBFSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.7.6 | CCCCC(CC(=O)O)C(=O)O | CACTVS 3.385 | CCCC[C@H](CC(O)=O)C(O)=O | ACDLabs 12.01 | O=C(O)C(CC(=O)O)CCCC | CACTVS 3.385 | CCCC[CH](CC(O)=O)C(O)=O | OpenEye OEToolkits 1.7.6 | CCCC[C@H](CC(=O)O)C(=O)O |
|
Name: | (2R)-2-butylbutanedioic acid; (2R)-2-butylsuccinic acid |
ZINC: | ZINC000003198940 |