EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H32O12S4 |
| Net Charge | 0 |
| Average Mass | 568.710 |
| Monoisotopic Mass | 568.07766 |
| SMILES | [H]OC([H])([H])[C@@]1([H])O[C@@]([H])(S[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])S[C@]1([H])O[C@]([H])(C([H])([H])O[H])[C@@]([H])(S[C@]2([H])O[C@]([H])(C([H])([H])O[H])[C@@]([H])(S[H])[C@]([H])(O[H])[C@@]2([H])O[H])[C@]([H])(O[H])[C@@]1([H])O[H] |
| InChI | InChI=1S/C18H32O12S4/c19-1-4-13(31)7(22)11(26)17(29-4)34-15-6(3-21)30-18(12(27)9(15)24)33-14-5(2-20)28-16(32)10(25)8(14)23/h4-27,31-32H,1-3H2/t4-,5-,6-,7-,8-,9-,10-,11-,12-,13-,14-,15-,16+,17+,18+/m1/s1 |
| InChIKey | WBVXJPVNEKGLBK-FBMSAYSMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1,4-DIMERCAPTO-ALPHA-D-GLUCOPYRANOSYL-(1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSYL-(1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSE (CHEBI:42194) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 1,4-DIMERCAPTO-ALPHA-D-GLUCOPYRANOSYL-(1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSYL-(1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSE | PDBeChem |
| 4-thio-beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-1,4-dithio-beta-D-glucopyranose | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| DP5 | PDBeChem |