EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H21NO4 |
| Net Charge | 0 |
| Average Mass | 315.369 |
| Monoisotopic Mass | 315.14706 |
| SMILES | O=C(O)Cc1ccc(OCCNC[C@H](O)c2ccccc2)cc1 |
| InChI | InChI=1S/C18H21NO4/c20-17(15-4-2-1-3-5-15)13-19-10-11-23-16-8-6-14(7-9-16)12-18(21)22/h1-9,17,19-20H,10-13H2,(H,21,22)/t17-/m0/s1 |
| InChIKey | SRBPKVWITYPHQR-KRWDZBQOSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethoxy]phenyl]acetic acid (CHEBI:93123) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3433 | LINCS |