EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C29H27NO4S |
| Net Charge | 0 |
| Average Mass | 485.605 |
| Monoisotopic Mass | 485.16608 |
| SMILES | O=C(NCc1ccccc1)C1=C[C@@H](c2csc3ccccc23)C[C@@H](OCc2ccc(CO)cc2)O1 |
| InChI | InChI=1S/C29H27NO4S/c31-17-21-10-12-22(13-11-21)18-33-28-15-23(25-19-35-27-9-5-4-8-24(25)27)14-26(34-28)29(32)30-16-20-6-2-1-3-7-20/h1-14,19,23,28,31H,15-18H2,(H,30,32)/t23-,28+/m1/s1 |
| InChIKey | HCHDWAVTMDCPLB-LXFBAYGMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S,4S)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-N-(phenylmethyl)-3,4-dihydro-2H-pyran-6-carboxamide (CHEBI:107615) is a 1-benzothiophenes (CHEBI:38836) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18971 | LINCS |