EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C32H50O8 |
| Net Charge | 0 |
| Average Mass | 562.744 |
| Monoisotopic Mass | 562.35057 |
| SMILES | CC1=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(=O)OC(C(C)C2CCC3C2CCC2C4CCCCC4CCC23)C1 |
| InChI | InChI=1S/C32H50O8/c1-16-13-26(39-31(37)25(16)15-38-32-30(36)29(35)28(34)27(14-33)40-32)17(2)19-9-10-24-21(19)11-12-22-20-6-4-3-5-18(20)7-8-23(22)24/h17-24,26-30,32-36H,3-15H2,1-2H3/t17?,18?,19?,20?,21?,22?,23?,24?,26?,27-,28-,29+,30-,32-/m1/s1 |
| InChIKey | NOAUMPXPHDYVDR-CUOCVKFKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| sterol 27-β-D-glucosides (CHEBI:193032) is a monosaccharide derivative (CHEBI:63367) |
| sterol 27-β-D-glucosides (CHEBI:193032) is a β-D-glucoside (CHEBI:22798) |
| Incoming Relation(s) |
| 5α,6β,17α-trihydroxywithanolide 27-O-β-D-glucoside (CHEBI:193036) is a sterol 27-β-D-glucosides (CHEBI:193032) |
| withanone 27-O-β-D-glucoside (CHEBI:193034) is a sterol 27-β-D-glucosides (CHEBI:193032) |
| UniProt Name | Source |
|---|---|
| a sterol 27-β-D-glucoside | UniProt |
| Manual Xrefs | Databases |
|---|---|
| Sterol-27-Glucosides | MetaCyc |
| Citations |
|---|