EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H41O7 |
| Net Charge | -1 |
| Average Mass | 417.563 |
| Monoisotopic Mass | 417.28578 |
| SMILES | C[C@H](CCCCCCCCCCC[C@@H](O)CC(=O)[O-])O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O |
| InChI | InChI=1S/C22H42O7/c1-16(28-22-20(25)15-19(24)17(2)29-22)12-10-8-6-4-3-5-7-9-11-13-18(23)14-21(26)27/h16-20,22-25H,3-15H2,1-2H3,(H,26,27)/p-1/t16-,17+,18-,19-,20-,22-/m1/s1 |
| InChIKey | QQIOQZRDFXAPQI-IGKFWFGWSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| bhas#28(1-) (CHEBI:139750) is a organic molecular entity (CHEBI:50860) |
| bhas#28(1-) (CHEBI:139750) is conjugate base of bhas#28 (CHEBI:79234) |
| Incoming Relation(s) |
| bhas#28 (CHEBI:79234) is conjugate acid of bhas#28(1-) (CHEBI:139750) |