PDB CCD ID: | KDD |
Number of entries in BioLiP: | 0 |
Chemical formula: | C8 H12 O6 |
InChI: | InChI=1S/C8H12O6/c9-3-5(11)6-1-4(10)2-7(14-6)8(12)13/h2,4-6,9-11H,1,3H2,(H,12,13)/t4-,5-,6+/m1/s1 |
InChIKey: | DVEBLXNKVWKMJU-PBXRRBTRSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | OC[CH](O)[CH]1C[CH](O)C=C(O1)C(O)=O | OpenEye OEToolkits 2.0.7 | C1C(C=C(OC1C(CO)O)C(=O)O)O | CACTVS 3.385 | OC[C@@H](O)[C@@H]1C[C@@H](O)C=C(O1)C(O)=O | OpenEye OEToolkits 2.0.7 | C1[C@H](OC(=CC1O)C(=O)O)[C@@H](CO)O |
|
Name: | 2,6-anhydro-3,5-dideoxy-D-ribo-oct-2-enonic acid; 5-deoxy-4-epi-2,3-dehydro-alpha-D-manno-oct-2-ulosonic acid |
ZINC: | ZINC000058639086 |