| Entry |
|
|---|
| Name |
Acetophenone;
1-Phenylethanone;
Phenyl methyl ketone;
Acetylbenzene;
Methyl phenyl ketone
|
|---|
| Formula |
C8H8O
|
|---|
| Exact mass |
120.0575
|
|---|
| Mol weight |
120.1485
|
|---|
| Structure |
     |
|---|
| Reaction |
|
|---|
| Pathway |
| Ethylbenzene degradation | | Microbial metabolism in diverse environments | | Degradation of aromatic compounds |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
CAS: 98-86-2 PubChem: ChEBI: ChEMBL: KNApSAcK: PDB-CCD: 3DMET: NIKKAJI: |
|---|
| KCF data |
ATOM 9
1 C8y C 28.8400 -16.5616
2 C8x C 27.6241 -17.2597
3 C8x C 30.0500 -17.2597
4 C5a C 28.8400 -15.1597
5 C8x C 27.6241 -18.6559
6 C8x C 30.0500 -18.6559
7 C1a C 30.0559 -14.4615
8 O5a O 27.6300 -14.4558
9 C8x C 28.8400 -19.3599
BOND 9
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 4 7 1
7 4 8 2
8 5 9 1
9 6 9 2
|
|---|
