EMBL-EBI | Chemical Biology | ChEBI
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| Formula | H2O.H2O4S.C27H38N2.H2O4S.C27H38N2 |
| Net Charge | 0 |
| Average Mass | 995.403 |
| Monoisotopic Mass | 994.55232 |
| SMILES | CCCCCCCC/N=C/N1CCC(C(c2ccccc2)c2ccccc2)CC1.CCCCCCCC/N=C/N1CCC(C(c2ccccc2)c2ccccc2)CC1.O.O=S(=O)(O)O.O=S(=O)(O)O |
| InChI | InChI=1S/2C27H38N2.2H2O4S.H2O/c2*1-2-3-4-5-6-13-20-28-23-29-21-18-26(19-22-29)27(24-14-9-7-10-15-24)25-16-11-8-12-17-25;2*1-5(2,3)4;/h2*7-12,14-17,23,26-27H,2-6,13,18-22H2,1H3;2*(H2,1,2,3,4);1H2/b2*28-23+;;; |
| InChIKey | DZLXKTCZFYOEES-FZGZZAAPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| fenoctimine sulfate (CHEBI:756163) is a diarylmethane (CHEBI:51614) |
| Synonyms | Source |
|---|---|
| Fenoctimine sulfate | ChEMBL |
| Fenoctimine sulfate hemihydrate | ChEMBL |
| Fenoctimine sulphate | ChEMBL |
| MCN-4097-12-98 | ChEMBL |