PDB CCD ID: | OIZ |
Number of entries in BioLiP: | 1 |
Chemical formula: | C6 H9 Cl O3 |
InChI: | InChI=1S/C6H9ClO3/c7-3-1-2-4(8)6(10)5(3)9/h1-6,8-10H/t3-,4-,5+,6+/m0/s1 |
InChIKey: | CGZQOMOYCGJBIC-UNTFVMJOSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 2.0.7 | C1=CC(C(C(C1O)O)O)Cl | OpenEye OEToolkits 2.0.7 | C1=C[C@@H]([C@H]([C@@H]([C@H]1O)O)O)Cl | CACTVS 3.385 | O[CH]1C=C[CH](Cl)[CH](O)[CH]1O | CACTVS 3.385 | O[C@H]1C=C[C@H](Cl)[C@@H](O)[C@@H]1O |
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Name: | (1~{S},2~{R},3~{S},6~{S})-6-chloranylcyclohex-4-ene-1,2,3-triol; L-carbaxylosyl chloride |