| Entry |
|
|---|
| Name |
Ecothiopate iodide (JP16/INN);
Echothiophate iodide (USP);
Phospholine iodide (TN)
|
|---|
| Product |
|
|---|
| Formula |
C9H23NO3PS. I
|
|---|
| Exact mass |
383.0181
|
|---|
| Mol weight |
383.2271
|
|---|
| Structure |
     |
|---|
| Activity |
Cholinergic [ophthalmic]
|
|---|
| Remark |
|
|---|
| Target |
acetylcholinesterase (AChE) inhibitor [HSA: 43] [KO: K01049] |
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| Structure map |
| Cholinergic and anticholinergic drugs |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
S SENSORY ORGANS
S01 OPHTHALMOLOGICALS
S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
S01EB Parasympathomimetics
S01EB03 Ecothiopate
D02193 Ecothiopate iodide (JP16/INN); Echothiophate iodide (USP)
USP drug classification [BR:br08302]
Ophthalmic Agents
Ophthalmic Antiglaucoma Agents
Cholinergic Agonists, Ophthalmic
Echothiophate
D02193 Ecothiopate iodide (JP16/INN); Echothiophate iodide (USP)
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases
acetylcholinesterase (AChE) [HSA:43] [KO:K01049]
Ecothiopate [ATC:S01EB03]
D02193 Ecothiopate iodide (JP16/INN); Echothiophate iodide (USP)
 |
|---|
| Other DBs |
CAS: 513-10-0 PubChem: DrugBank: LigandBox: NIKKAJI: |
|---|
| KCF data |
ATOM 16
1 O2b O 27.0988 -16.1378
2 P1b P 28.3142 -15.4367
3 S2a S 29.5294 -16.1378
4 C1b C 30.6980 -15.4367
5 C1b C 31.9132 -16.1378
6 N1d N 33.1286 -15.4367 #+
7 C1a C 34.3438 -16.1378
8 O3b O 27.0521 -14.7355
9 C1b C 27.0988 -17.5400
10 C1a C 25.8836 -18.2412
11 O2b O 29.4826 -14.7355
12 C1b C 29.4827 -13.3333
13 C1a C 30.6980 -12.6322
14 C1a C 33.1286 -14.0344
15 C1a C 34.5538 -14.7355
16 X I 33.1567 -17.5000 #-
BOND 14
1 2 8 2
2 3 4 1
3 1 9 1
4 1 2 1
5 9 10 1
6 4 5 1
7 2 11 1
8 11 12 1
9 5 6 1
10 12 13 1
11 2 3 1
12 6 14 1
13 6 7 1
14 6 15 1
|
|---|
