EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C30H33BrN4O2 |
| Net Charge | 0 |
| Average Mass | 561.524 |
| Monoisotopic Mass | 560.17869 |
| SMILES | COc1ccc(C[C@H]2CN3C(=NC[C@H]3Cc3ccccc3)N2CCNC(=O)c2ccc(C)c(Br)c2)cc1 |
| InChI | InChI=1S/C30H33BrN4O2/c1-21-8-11-24(18-28(21)31)29(36)32-14-15-34-26(17-23-9-12-27(37-2)13-10-23)20-35-25(19-33-30(34)35)16-22-6-4-3-5-7-22/h3-13,18,25-26H,14-17,19-20H2,1-2H3,(H,32,36)/t25-,26+/m1/s1 |
| InChIKey | HQCFZNPEJFNWGY-FTJBHMTQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-bromo-N-[2-[(3R,6S)-6-[(4-methoxyphenyl)methyl]-3-(phenylmethyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]ethyl]-4-methylbenzamide (CHEBI:112324) is a carbonyl compound (CHEBI:36586) |
| 3-bromo-N-[2-[(3R,6S)-6-[(4-methoxyphenyl)methyl]-3-(phenylmethyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]ethyl]-4-methylbenzamide (CHEBI:112324) is a organohalogen compound (CHEBI:17792) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23736 | LINCS |