EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H30O12 |
| Net Charge | 0 |
| Average Mass | 426.415 |
| Monoisotopic Mass | 426.17373 |
| SMILES | CC(C)(O)[C@H]1CO[C@H]2[C@H](O1)[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]2CO |
| InChI | InChI=1S/C17H30O12/c1-17(2,24)8-5-25-13-7(4-19)27-16(12(23)14(13)28-8)29-15-11(22)10(21)9(20)6(3-18)26-15/h6-16,18-24H,3-5H2,1-2H3/t6-,7-,8-,9-,10+,11-,12-,13-,14-,15-,16-/m1/s1 |
| InChIKey | QEPIZJRJOJDKQJ-NLIDIAEPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Lentzeaspecies ML457-mF8 (ncbitaxon:1366560) | - | PubMed (25757606) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Lentztrehalose C (CHEBI:212274) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| (2R,3R,4S,5S,6R)-2-[[(2R,4aR,5R,7R,8R,8aR)-8-hydroxy-5-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-3,4a,5,7,8,8a-hexahydro-2H-pyrano[3,4-b][1,4]dioxin-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol |