The Biofilms Structural Database
|
|
The Biofilms Structural Database |
NNQ |
|
|---|---|
4JVD |
|
Code
NNQ | |
|
Name |
2-nonylquinolin-4(1H)-one |
|
Molecular Weight |
271.4 |
|
Isomeric SMILES |
CCCCCCCCCc1cc(=O)c2ccccc2[nH]1 |
|
Formula |
C18H25NO |
|
Identifiers |
2-nonyl-1H-quinolin-4-one |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C18H25NO/c1-2-3-4-5-6-7-8-11-15-14-18(20)16-12-9-10-13-17(16)19-15/h9-10,12-14H,2-8,11H2,1H3,(H,19,20) |
|
Atom Count |
45 |
|
InChIKey |
KKRXDNYRUZGPFM-UHFFFAOYSA-N |
|
PDB codes |
4JVD |
|
Type |
Non-polymer |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
46 |
|
Aromatic Bond Count |
6 |
|
Leaving Atoms |
n/a |