3NB
1-(3,4,5-trihydroxyphenyl)octan-1-one
Find entries where: 3NB
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 1-(3,4,5-trihydroxyphenyl)octan-1-one |
| Identifiers | 1-[3,4,5-tris(oxidanyl)phenyl]octan-1-one |
| Formula | C14 H20 O4 |
| Molecular Weight | 252.306 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCCCCCCC(=O)c1cc(c(c(c1)O)O)O |
| InChI | InChI=1S/C14H20O4/c1-2-3-4-5-6-7-11(15)10-8-12(16)14(18)13(17)9-10/h8-9,16-18H,2-7H2,1H3 |
| InChIKey | XPNDSNQZWXZZAW-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 38 |
| Chiral Atom Count | 0 |
| Bond Count | 38 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 44567299 |
| ChEMBL | CHEMBL464852 |
