EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H29O7 |
| Net Charge | -1 |
| Average Mass | 333.401 |
| Monoisotopic Mass | 333.19188 |
| SMILES | C[C@H](CCCCC[C@@H](O)CC(=O)[O-])O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O |
| InChI | InChI=1S/C16H30O7/c1-10(6-4-3-5-7-12(17)8-15(20)21)22-16-14(19)9-13(18)11(2)23-16/h10-14,16-19H,3-9H2,1-2H3,(H,20,21)/p-1/t10-,11+,12-,13-,14-,16-/m1/s1 |
| InChIKey | XLKCBPRCWUMKHY-NVWMEEMDSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| bhas#16(1-) (CHEBI:139730) is a organic molecular entity (CHEBI:50860) |
| bhas#16(1-) (CHEBI:139730) is conjugate base of bhas#16 (CHEBI:79227) |
| Incoming Relation(s) |
| bhas#16 (CHEBI:79227) is conjugate acid of bhas#16(1-) (CHEBI:139730) |