Chemical Component Summary |
|---|
| Name | 1,1'-ETHANE-1,2-DIYLBIS(3,7-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE) |
|---|
| Synonyms | 1-(2-(THEOBROMINE-1-YL)ETHYL)-BROMINE |
|---|
| Identifiers | 1-[2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)ethyl]-3,7-dimethyl-purine-2,6-dione |
|---|
| Formula | C16 H18 N8 O4 |
|---|
| Molecular Weight | 386.365 |
|---|
| Type | NON-POLYMER |
|---|
| Isomeric SMILES | Cn1cnc2c1C(=O)N(C(=O)N2C)CCN3C(=O)c4c(ncn4C)N(C3=O)C |
|---|
| InChI | InChI=1S/C16H18N8O4/c1-19-7-17-11-9(19)13(25)23(15(27)21(11)3)5-6-24-14(26)10-12(18-8-20(10)2)22(4)16(24)28/h7-8H,5-6H2,1-4H3 |
|---|
| InChIKey | DHOOHIKQTUGDOW-UHFFFAOYSA-N |
|---|
