EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C32H58O12 |
| Net Charge | 0 |
| Average Mass | 634.804 |
| Monoisotopic Mass | 634.39283 |
| SMILES | CCCCCCCCCCCCCCCC(=O)O[C@H]1[C@H](O)[C@@H](COC(C)=O)O[C@@H](OC[C@@H](O)[C@@H](O)CO)[C@H]1OC(=O)C(C)C |
| InChI | InChI=1S/C32H58O12/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27(37)43-29-28(38)26(21-40-23(4)34)42-32(30(29)44-31(39)22(2)3)41-20-25(36)24(35)19-33/h22,24-26,28-30,32-33,35-36,38H,5-21H2,1-4H3/t24-,25+,26+,28+,29-,30-,32+/m0/s1 |
| InChIKey | VBCXVYMNXRSHQB-RHGYXRJGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Geotrichum (ncbitaxon:43987) | - | PubMed (12715867) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ustilipid D2 (CHEBI:199264) is a lipopolysaccharide (CHEBI:16412) |
| IUPAC Name |
|---|
| [(2R,3R,4S,5S,6R)-2-(acetyloxymethyl)-3-hydroxy-5-(2-methylpropanoyloxy)-6-[(2R,3S)-2,3,4-trihydroxybutoxy]oxan-4-yl] hexadecanoate |
| Manual Xrefs | Databases |
|---|---|
| 9051218 | ChemSpider |