EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:142478 - 2-O-sulfo-2'-O-stearoyl-α,α-trehalose(1−)
| Formula | C30H55O15S |
| Net Charge | -1 |
| Average Mass | 687.822 |
| Monoisotopic Mass | 687.32672 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)O[C@H]1[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OS(=O)(=O)[O-])O[C@H](CO)[C@@H](O)[C@@H]1O |
| InChI | InChI=1S/C30H56O15S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)43-27-25(36)23(34)20(18-31)41-29(27)44-30-28(45-46(38,39)40)26(37)24(35)21(19-32)42-30/h20-21,23-32,34-37H,2-19H2,1H3,(H,38,39,40)/p-1/t20-,21-,23-,24-,25+,26+,27-,28-,29-,30-/m1/s1 |
| InChIKey | FJSYDIDIVMGPGY-VEFFTAHGSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-O-sulfo-2'-O-stearoyl-α,α-trehalose(1−) (CHEBI:142478) has functional parent α,α-trehalose (CHEBI:16551) |
| 2-O-sulfo-2'-O-stearoyl-α,α-trehalose(1−) (CHEBI:142478) is a organosulfate oxoanion (CHEBI:58958) |
| 2-O-sulfo-2'-O-stearoyl-α,α-trehalose(1−) (CHEBI:142478) is a polyacyl α,α-trehalose derivative (CHEBI:62552) |
| 2-O-sulfo-2'-O-stearoyl-α,α-trehalose(1−) (CHEBI:142478) is a trehalose sulfate (CHEBI:60117) |
| UniProt Name | Source |
|---|---|
| 2-O-sulfo-2'-O-octadecanoyl-α,α-trehalose | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-18713 | MetaCyc |
| Citations |
|---|