IDU
Summary
| Name: | 2-O-sulfo-beta-L-altropyranuronic acid |
| Synonyms: | 2-O-sulfo-beta-L-altruronic acid 2-O-sulfo-L-altruronic acid; 2-O-sulfo-altruronic acid |
| Formula: | C6 H10 O10 S |
| Formal charge: | 0 |
| Formula weight: | 274.203 Da |
| Component type: | L-saccharide, beta linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-O-sulfo-beta-L-altropyranuronic acid |
| OpenEye OEToolkits | 1.7.0 | (2R,3R,4S,5R,6S)-3,4,6-trihydroxy-5-sulfooxy-oxane-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1OC(O)C(OS(=O)(=O)O)C(O)C1O |
| SMILES_CANONICAL | CACTVS | 3.370 | O[C@H]1O[C@H]([C@H](O)[C@H](O)[C@H]1O[S](O)(=O)=O)C(O)=O |
| SMILES | CACTVS | 3.370 | O[CH]1O[CH]([CH](O)[CH](O)[CH]1O[S](O)(=O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | [C@@H]1([C@H]([C@@H](O[C@@H]([C@@H]1OS(=O)(=O)O)O)C(=O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C1(C(C(OC(C1OS(=O)(=O)O)O)C(=O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H10O10S/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10/h1-4,6-8,11H,(H,9,10)(H,12,13,14)/t1-,2+,3-,4-,6+/m1/s1 |
| InChIKey | InChI | 1.03 | COJBCAMFZDFGFK-TVSWGBMESA-N |
