Chemical Component Summary | |
|---|---|
| Name | 3-bromo dicyclotyrosine |
| Identifiers | (3~{S},6~{S})-3-[(3-bromanyl-4-oxidanyl-phenyl)methyl]-6-[(4-hydroxyphenyl)methyl]piperazine-2,5-dione |
| Formula | C18 H17 Br N2 O4 |
| Molecular Weight | 405.243 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(ccc1C[C@H]2C(=O)N[C@H](C(=O)N2)Cc3ccc(c(c3)Br)O)O |
| InChI | InChI=1S/C18H17BrN2O4/c19-13-7-11(3-6-16(13)23)9-15-18(25)20-14(17(24)21-15)8-10-1-4-12(22)5-2-10/h1-7,14-15,22-23H,8-9H2,(H,20,25)(H,21,24)/t14-,15-/m0/s1 |
| InChIKey | UHZMUUVMCUUKRQ-GJZGRUSLSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 42 |
| Chiral Atom Count | 2 |
| Bond Count | 44 |
| Aromatic Bond Count | 12 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 146020569 |
