Compound Summary
Compound Information
ATROPINE METHYL BROMIDE
Compound Name: | ATROPINE METHYL BROMIDE |
Compound CID: | 656597 |
Synonyms: | ATROPINE METHYL BROMIDE Atropine methylbromide Methylatropine bromide 2870-71-5 Mintussin More... |
Iupac Name: | [(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate;bromide |
InChI: | InChI=1S/C18H26NO3.BrH/c1-19(2)14-8-9-15(19)11-16(10-14)22-18(21)17(12-20)13-6-4-3-5-7-13;/h3-7,14-17,20H,8-12H2,1-2H3;1H/q+1;/p-1/t14-,15+,16?,17?; |
InChIKey: | XMLNCADGRIEXPK-ZNHDNBJUSA-M |
Canonical Smiles: | C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-] |
Isomeric Smiles: | C[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-] |
Molecular Weight: | 384.3 |
Molecular Formula: | C18H26BrNO3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
ATROPINE METHYL BROMIDE
Molecular Weight: | 384.3 |
Molecular Formula: | C18H26BrNO3 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 23 |
Complexity: | 387 |
Synonyms
ATROPINE METHYL BROMIDE
| ATROPINE METHYL BROMIDE | ATROPINE METHYL BROMIDE |
|---|---|
ATROPINE METHYL BROMIDE |
Atropine methylbromide |
Methylatropine bromide |
2870-71-5 |
Mintussin |
Mydriasin |
Atropine methylbromide JAN |
Atropine methobromide |
Methylatropinium bromide |
N-Methylatropine bromide |
8-Methylatropinium bromide |
Atropine methylbromide (JAN) |
endo-3-((3-Hydroxy-2-phenylpropanoyl)oxy)-8,8-dimethyl-8-azabicyclo3.2.1octan-8-ium bromide |
Methylatropini bromidum |
Atropinum methylobromatum |
Methylatropinium bromidum |
N-Methylatropinium bromide |
Methylatropine (bromure de) |
C18H26NO3.Br |
Atropinium, 8-methyl-, bromide |
EINECS 220-700-1 |
NSC 61810 |
DSSTox_CID_25103 |
DSSTox_RID_80671 |
DSSTox_GSID_45103 |
CHEMBL2146143 |
DTXSID2045103 |
(RS)-8-Methyl-3alpha-tropoyloxy-1alphaH,5alphaH-tropaniumbromid |
8-Azoniabicyclo(3.2.1)octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-, bromide (1:1), (3-endo)- |
Tox21_110038 |
6458AF |
3-alpha-Hydroxy-8-methyl-1-alpha,5-alpha-H-tropanium bromide (+-)tropate |
AKOS030524312 |
NCGC00013725-01 |
CAS-2870-71-5 |
HY-112076 |
CS-0043286 |
D03814 |
Q27263618 |
3alpha-Hydroxy-8-methyl-1alphaH,5alphaH-tropanium bromide |
(8,8-dimethyl-8-azoniabicyclo3.2.1octan-3-yl) 3-hydroxy-2-phenylpropanoate,bromide |
1-alpha-H,5-alpha-H-Tropanium, 3-alpha-hydroxy-8-methyl-, bromide, (+-)-tropate (ester) |
1alphaH,5alphaH-Tropanium, 3alpha-hydroxy-8-methyl-, bromide, (+-)-tropate (8CI) |
8-Azoniabicyclo(3.2.1)octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-, bromide, (3-endo)- |
8-Azoniabicyclo(3.2.1)octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-, bromide, endo-(+-)- |
Experimental Data
ATROPINE METHYL BROMIDE
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | -6 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
ATROPINE METHYL BROMIDE
Statistics Data
ATROPINE METHYL BROMIDE
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -6 | 1 | 1 |
Statistics Data Visualization
ATROPINE METHYL BROMIDE
