| PDB CCD ID: | EXO |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C7 H12 O4 |
| InChI: | InChI=1S/C7H12O4/c1-3-2-4(8)6(10)7(11)5(3)9/h4-11H,1-2H2/t4-,5-,6+,7+/m1/s1 |
| InChIKey: | DRZDCPGIBPDBFY-JWXFUTCRSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | C=C1C[C@H]([C@@H]([C@H]([C@@H]1O)O)O)O | | CACTVS 3.341 | O[C@@H]1CC(=C)[C@@H](O)[C@H](O)[C@H]1O | | ACDLabs 10.04 | OC1CC(=C)/C(O)C(O)C1O | | CACTVS 3.341 | O[CH]1CC(=C)[CH](O)[CH](O)[CH]1O | | OpenEye OEToolkits 1.5.0 | C=C1CC(C(C(C1O)O)O)O |
|
| Name: | (1R,2S,3S,4R)-5-METHYLENECYCLOHEXANE-1,2,3,4-TETRAOL |
umich.edu