| Entry |
|
|---|
| Name |
Phloroglucinol (JAN);
Dilospan S (TN) |
|---|
| Formula |
C6H6O3
|
|---|
| Exact mass |
126.0317
|
|---|
| Mol weight |
126.11
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01497 Catechol O-methyltransferase inhibitor
|
|---|
| Remark |
|
|---|
| Efficacy |
Antispasmodic, Cathechol-O-methyltransferase (COMT) inhibitor |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Structure map |
| map07216 | Catecholamine transferase inhibitors |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03A DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03AX Other drugs for functional gastrointestinal disorders
A03AX12 Phloroglucinol
D00152 Phloroglucinol (JAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01497 Catechol O-methyltransferase inhibitor
DG00050 Phloroglucinol
D00152 Phloroglucinol
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Methyltransferases
COMT
D00152 Phloroglucinol (JAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01497 Catechol O-methyltransferase inhibitor
DG00050 Phloroglucinol
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 9
1 C8y C 17.2005 -16.1739
2 C8x C 17.2005 -14.7661
3 C8x C 18.4037 -16.8844
4 O1a O 15.9908 -16.8651
5 C8y C 18.4037 -14.0684
6 C8y C 19.6260 -16.1739
7 C8x C 19.6260 -14.7661
8 O1a O 18.4037 -12.6796
9 O1a O 20.8355 -16.8651
BOND 9
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 5 7 1
7 5 8 1
8 6 9 1
9 6 7 2
|
|---|
