3MJ
1-(3,4,5-trihydroxyphenyl)dodecan-1-one
Find entries where: 3MJ
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 1-(3,4,5-trihydroxyphenyl)dodecan-1-one |
| Identifiers | 1-[3,4,5-tris(oxidanyl)phenyl]dodecan-1-one |
| Formula | C18 H28 O4 |
| Molecular Weight | 308.413 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O |
| InChI | InChI=1S/C18H28O4/c1-2-3-4-5-6-7-8-9-10-11-15(19)14-12-16(20)18(22)17(21)13-14/h12-13,20-22H,2-11H2,1H3 |
| InChIKey | TXMSPHFHTXABMF-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 50 |
| Chiral Atom Count | 0 |
| Bond Count | 50 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 44567301 |
| ChEMBL | CHEMBL464854 |
