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| Ligand ID | 15L |
| InChI | InChI=1S/C6H8O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,7-9H,(H,10,11)/t1-,2+,3+,4-/m0/s1 |
| InChIKey | YLKFQNUGXOLRNI-KXMYSMCESA-N |
| SMILES | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.0 | [C@@H]1([C@H]([C@H](OC(=O)[C@@H]1O)C(=O)O)O)O | | CACTVS 3.370 | O[C@H]1[C@@H](O)[C@H](OC(=O)[C@@H]1O)C(O)=O | | OpenEye OEToolkits 1.7.0 | C1(C(C(OC(=O)C1O)C(=O)O)O)O | | CACTVS 3.370 | O[CH]1[CH](O)[CH](OC(=O)[CH]1O)C(O)=O | | ACDLabs 12.01 | O=C(O)C1OC(=O)C(O)C(O)C1O |
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| Formula | C6 H8 O7 |
| Name | D-galactaro-1,5-lactone;
galactaro-1,5-lactone;
(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-oxidotetrahydro-2H-pyran-2-carboxylate |
| ChEMBL | |
| DrugBank | |
| ZINC |
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| PDB chain | 3rfv Chain B Residue 401
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[Download structure with residue number starting from 1]
[View ligand structure]
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