Compound Summary
Compound Information
PINAVERIUM BROMIDE
Compound Name: | PINAVERIUM BROMIDE |
Compound CID: | 40703 |
Synonyms: | PINAVERIUM BROMIDE 53251-94-8 Pinaverium bromide INN Dicetel Pinaverium bromide (INN) More... |
Iupac Name: | 4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]morpholin-4-ium;bromide |
InChI: | InChI=1S/C26H41BrNO4.BrH/c1-26(2)21-6-5-19(22(26)16-21)7-11-31-12-8-28(9-13-32-14-10-28)18-20-15-24(29-3)25(30-4)17-23(20)27;/h15,17,19,21-22H,5-14,16,18H2,1-4H3;1H/q+1;/p-1 |
InChIKey: | IKGXLCMLVINENI-UHFFFAOYSA-M |
Canonical Smiles: | CC1(C2CCC(C1C2)CCOCC[N+]3(CCOCC3)CC4=CC(=C(C=C4Br)OC)OC)C.[Br-] |
Isomeric Smiles: | CC1(C2CCC(C1C2)CCOCC[N+]3(CCOCC3)CC4=CC(=C(C=C4Br)OC)OC)C.[Br-] |
Molecular Weight: | 591.4 |
Molecular Formula: | C26H41Br2NO4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
PINAVERIUM BROMIDE
Molecular Weight: | 591.4 |
Molecular Formula: | C26H41Br2NO4 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 10 |
Heavy Atom Count: | 33 |
Complexity: | 596 |
Synonyms
PINAVERIUM BROMIDE
| PINAVERIUM BROMIDE | PINAVERIUM BROMIDE |
|---|---|
PINAVERIUM BROMIDE |
53251-94-8 |
Pinaverium bromide INN |
Dicetel |
Pinaverium bromide (INN) |
Morpholinium, 4-(2-bromo-4,5-dimethoxyphenyl)methyl-4-2-2-(6,6-dimethylbicyclo3.1.1hept-2-yl)ethoxyethyl-, bromide (1:1) |
Pinaverii bromidum |
UNII-7SCF54H12J |
4-(2-Bromo-4,5-dimethoxybenzyl)-4-(2-(2-(6,6-dimethylbicyclo3.1.1heptan-2-yl)ethoxy)ethyl)morpholin-4-ium bromide |
Bromuro de pinaverio |
Bromure de pinaverium |
Pinaverii bromidum INN-Latin |
LAT 1717 |
Bromure de pinaverium INN-French |
Bromuro de pinaverio INN-Spanish |
4-(2-bromo-4,5-dimethoxyphenyl)methyl-4-2-2-(6,6-dimethyl-2-bicyclo3.1.1heptanyl)ethoxyethylmorpholin-4-ium;bromide |
NCGC00181763-01 |
EINECS 258-450-0 |
7SCF54H12J |
LAT-1717 |
L-Pinaverium bromide |
PINAVERIUMBROMIDE-D4 |
4-(6-Bromoveratryl)-4-(2-(2-(6,6-dimethyl-2-norpinyl)ethoxy)ethyl)morpholinium bromide |
DSSTox_CID_28540 |
DSSTox_RID_82812 |
DSSTox_GSID_48614 |
SCHEMBL25474 |
C26H41Br2NO4 |
Morpholinium, 4-(2-bromo-4,5-dimethoxy)benzyl-4-(2-(2-(6,6-dimethyl-2-norpinyl)ethoxy)ethyl)-, bromide |
CHEMBL1909298 |
DTXSID2048614 |
4-(2-bromo-4,5-dimethoxy-phenyl)methyl-4-2-2-(1S,5S)-6,6-dimethylnorpinan-2-ylethoxyethylmorpholin-4-ium bromide |
BCP21168 |
Tox21_112949 |
AKOS015918115 |
GS-6842 |
Q784 |
CAS-53251-94-8 |
HY-111613 |
CS-0088569 |
FT-0673906 |
D07094 |
LAT 1717; LAT-1717; LAT1717 |
A870784 |
Q27268790 |
4-(2-Bromo-4,5-dimethoxybenzyl)-4-{2-2-(6,6-dimethylbicyclo3.1.1hept-2-yl)ethoxyethyl}morpholin-4-ium bromide |
4-(2-BROMO-4,5-DIMETHOXY-PHENYL)METHYL-4-2-2-(6,6-DIMETHYLNORPINAN-2-YL)ETHOXYETHYL-1-OXA-4-AZONIACYCLOHEXANE BROMIDE |
4-(2-BROMO-4,5-DIMETHOXYPHENYL)METHYL-4-2-(2-{6,6-DIMETHYLBICYCLO3.1.1HEPTAN-2-YL}ETHOXY)ETHYLMORPHOLIN-4-IUM BROMIDE |
Morpholinium,4-(2-bromo-4,5-dimethoxyphenyl)methyl-4-2-2-(6,6-dimethylbicyclo3.1.1hept-2-yl)ethoxyethyl-, bromide |
Experimental Data
PINAVERIUM 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Drosophila melanogaster | 20 | umol/L | 45.44 | 47.98 | 5.593 | NS | FEMALES | 33008901 | Inactive | ||||
| Caenorhabditis elegans | 10 | umol/L | 15.13 | 14.86 | -1.788 | NS | N2 | 33008901 | Inactive | ||||
| Caenorhabditis elegans | 100 | umol/L | 16.61 | 13.64 | -17.89 | NS | N2 | 33008901 | Inactive | ||||
| Drosophila melanogaster | 200 | umol/L | 44.8 | 46.13 | 2.975 | NS | MALES | 33008901 | Inactive |
Experimental Data Visualization
PINAVERIUM BROMIDE
Statistics Data
PINAVERIUM BROMIDE
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -1.788 | 1 | 2 | |
| Drosophila melanogaster | 5.593 | 1 | 2 |
Statistics Data Visualization
PINAVERIUM BROMIDE
