EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C27H32N6O4 |
| Net Charge | 0 |
| Average Mass | 504.591 |
| Monoisotopic Mass | 504.24850 |
| SMILES | COc1ccc(N2CCN(CCCNC(=O)Cn3c(=O)c4cccn4c4cccnc43)CC2)c(OC)c1 |
| InChI | InChI=1S/C27H32N6O4/c1-36-20-8-9-21(24(18-20)37-2)31-16-14-30(15-17-31)12-5-11-28-25(34)19-33-26-22(6-3-10-29-26)32-13-4-7-23(32)27(33)35/h3-4,6-10,13,18H,5,11-12,14-17,19H2,1-2H3,(H,28,34) |
| InChIKey | ZUAAACBIEWKSNS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-2884 (CHEBI:92701) is a piperazines (CHEBI:26144) |
| Manual Xrefs | Databases |
|---|---|
| LSM-2884 | LINCS |