Compound Summary
Methacholine chloride
Compound Information
Methacholine chloride
Compound Name: | Methacholine chloride |
Compound CID: | 6114 |
Synonyms: | Methacholine chloride 62-51-1 Acetyl-beta-methylcholine chloride Provocholine Mecholyl chloride More... |
Iupac Name: | 2-acetyloxypropyl(trimethyl)azanium;chloride |
InChI: | InChI=1S/C8H18NO2.ClH/c1-7(11-8(2)10)6-9(3,4)5;/h7H,6H2,1-5H3;1H/q+1;/p-1 |
InChIKey: | JHPHVAVFUYTVCL-UHFFFAOYSA-M |
Canonical Smiles: | CC(C[N+](C)(C)C)OC(=O)C.[Cl-] |
Isomeric Smiles: | CC(C[N+](C)(C)C)OC(=O)C.[Cl-] |
Molecular Weight: | 195.69 |
Molecular Formula: | C8H18ClNO2 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Methacholine chloride
Molecular Weight: | 195.69 |
Molecular Formula: | C8H18ClNO2 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 12 |
Complexity: | 138 |
Synonyms
Methacholine chloride
| Methacholine chloride | Methacholine chloride |
|---|---|
Methacholine chloride |
62-51-1 |
Acetyl-beta-methylcholine chloride |
Provocholine |
Mecholyl chloride |
Methacholine (chloride) |
Acetyl-2-methylcholine Chloride |
1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride |
(2-Acetoxypropyl)trimethylammonium chloride |
2-acetyloxypropyl(trimethyl)azanium;chloride |
O-Acetyl-beta-methylcholine chloride |
Acetyl-|A-methylcholine chloride |
MLS000069656 |
CHEBI:50142 |
Amechol |
Mecholyl |
Provokit |
SMR000059224 |
DSSTox_CID_3271 |
Mecholine chloride |
DSSTox_RID_76951 |
DSSTox_GSID_23271 |
2-acetyloxy-N,N,N-trimethylpropan-1-aminium chloride |
Methacholinium chloride |
UNII-0W5ETF9M2K |
1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride (1:1) |
Metacolina cloruro |
Metacolina cloruro DCIT |
Cloruro de metacolina |
Methacholini chloridum |
beta-Methylacetylcholine chloride |
Cloruro de metacolina Spanish |
Chlorure de methacholine French |
Chlorure de methacholine |
SR-01000000215 |
Methacholini chloridum INN-Latin |
EINECS 200-537-2 |
Cloruro de metacolina INN-Spanish |
DL-Acetyl-beta-methylcholine chloride |
Chlorure de methacholine INN-French |
(+-)-Acetyl-beta-methylcholine chloride |
AI3-51680 |
0W5ETF9M2K |
Trimethyl-beta-acetoxypropylammonium chloride |
Prestwick_981 |
Provocholine (TN) |
(2-Hydroxypropyl)trimethylammonium chloride acetate |
Methacholine Chloride, Crystal, USP |
Methacholine chloride USP:INN:BAN |
CAS-62-51-1 |
Opera_ID_1285 |
NCGC00016282-01 |
REGID_for_CID_6114 |
SCHEMBL69104 |
MLS001148375 |
SPECTRUM1500391 |
(+-)-(2-Hydroxypropyl)trimethylammonium chloride acetate |
CHEMBL1200764 |
DTXSID7023271 |
Acetyl-ss--methylcholine chloride |
HMS1570G20 |
HMS1920L11 |
HMS2091D06 |
HMS2097G20 |
HMS2232B07 |
HMS3260E11 |
HMS3371L18 |
HMS3714G20 |
HMS3885A21 |
Pharmakon1600-01500391 |
O-Acetyl-|A-methylcholine Chloride |
AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-, CHLORIDE, ACETATE |
HY-A0083 |
Tox21_110348 |
Tox21_500025 |
1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride, (+-)- |
7986AF |
CCG-39988 |
MFCD00011817 |
NSC757090 |
Acetyl b-methylcholine chloride 98%+ |
AKOS015892295 |
Methacholine chloride (JAN/USP/INN) |
Tox21_110348_1 |
FS-4023 |
LP00025 |
MCULE-3342474130 |
NSC 757090 |
NSC-757090 |
NCGC00015045-09 |
NCGC00093548-01 |
NCGC00093548-02 |
NCGC00093548-03 |
NCGC00093548-04 |
NCGC00093548-05 |
NCGC00260710-01 |
DB-054187 |
EU-0100025 |
FT-0628268 |
M0073 |
ST51039038 |
A 2251 |
A-1480 |
C75939 |
D04970 |
A833819 |
1-methyl-2-(trimethylamino)ethyl acetate, chloride |
2-acetoxy-N,N,N-trimethylpropan-1-aminium chloride |
Q-200715 |
SR-01000000215-2 |
SR-01000000215-4 |
SR-01000000215-7 |
Q26841250 |
2-(acetyloxy)-N,N,N-trimethylpropan-1-aminium chloride |
(+/-)-(2-Hydroxypropyl)trimethylammonium chloride acetate |
Experimental Data
Methacholine chloride
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | -12.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Methacholine chloride
Statistics Data
Methacholine chloride
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -12.000000000000000 | 1 | 1 |
Statistics Data Visualization
Methacholine chloride
