Compound Summary
BUTACLAMOL HYDROCHLORIDE
Compound Information
BUTACLAMOL HYDROCHLORIDE
Compound Name: | BUTACLAMOL HYDROCHLORIDE |
Compound CID: | 37460 |
Synonyms: | BUTACLAMOL HYDROCHLORIDE Butaclamol HCl Butaclamol hydrochloride USAN (-)-Butaclamol hydrochloride 36504-94-6 (HCl) More... |
Iupac Name: | (1R,6R,8R)-6-tert-butyl-3-azapentacyclo[11.8.1.03,8.09,22.016,21]docosa-9,11,13(22),16,18,20-hexaen-6-ol;hydrochloride |
InChI: | InChI=1S/C25H31NO.ClH/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25;/h4-10,21-22,27H,11-16H2,1-3H3;1H/t21-,22-,25-;/m1./s1 |
InChIKey: | QZRUMKUMFJJARD-OMMJFLKZSA-N |
Canonical Smiles: | CC(C)(C)C1(CCN2CC3C4=CC=CC=C4CCC5=C3C(=CC=C5)C2C1)O.Cl |
Isomeric Smiles: | CC(C)(C)[C@]1(CCN2C[C@@H]3C4=CC=CC=C4CCC5=C3C(=CC=C5)[C@H]2C1)O.Cl |
Molecular Weight: | 398 |
Molecular Formula: | C25H32ClNO |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
BUTACLAMOL HYDROCHLORIDE
Molecular Weight: | 398 |
Molecular Formula: | C25H32ClNO |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 2 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 28 |
Complexity: | 553 |
Synonyms
BUTACLAMOL HYDROCHLORIDE
| BUTACLAMOL HYDROCHLORIDE | BUTACLAMOL HYDROCHLORIDE |
|---|---|
BUTACLAMOL HYDROCHLORIDE |
Butaclamol HCl |
Butaclamol hydrochloride USAN |
(-)-Butaclamol hydrochloride |
36504-94-6 (HCl) |
36504-94-6 |
55528-08-0 |
AY 23028 |
Butaclamol hydrochloride (USAN) |
(3R,4aR,13bR)-3-(1,1-Dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo6,7cyclohepta1,2,3-depyrido2,1-aisoquinolin-3-ol hydrochloride |
AY-23,028 |
(-)-Butaclamolhydrochloride |
(+-)-3alpha-tert-Butyl-2,3,4,4abeta,8,9,13balpha,14-octahydro-1H-benzo(6,7)-cyclohepta(1,2,3-de)pyrido(2,1-a)isoquinolin-3-ol hydrochloride |
DTXSID0045757 |
(-)-Butaclamol hydrochloride, solid |
1H-Benzo(6,7)cyclohepta(1,2,3-de)-pyrido(2,1-a)isoquinolin-3-ol, 3-(1,1-dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-, hydrochloride, (3alpha,4aalpha,13bbeta)-(+-)- |
1H-Benzo(6,7)cyclohepta(1,2,3-de)pyrido(2,1-alpha)isoquinolin-3-ol, 2,3,4,4a,8,9,13b,14-octahydro-3-(1,1-dimethylethyl)-, hydrochloride, (3-alpha,4a-alpha,13b-beta)-(+-)- |
D02641 |
Q27271006 |
UNII-8TUG8SF12T component QZRUMKUMFJJARD-OMMJFLKZSA-N |
(1R,6R,8R)-6-tert-butyl-3-azapentacyclo11.8.1.03,8.09,22.016,21docosa-9,11,13(22),16,18,20-hexaen-6-ol;hydrochloride |
Experimental Data
BUTACLAMOL HYDROCHLORIDE
| 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 | 100.000000000000000 | umol/L | 17.400000000000000 | 15.670000000000000 | -9.951000000000000 | NS | N2 | 33008901 | Inactive | ||||
| Caenorhabditis elegans | 10.000000000000000 | umol/L | 15.130000000000000 | 15.060000000000000 | -0.413400000000000 | NS | N2 | 33008901 | Inactive |
Experimental Data Visualization
BUTACLAMOL HYDROCHLORIDE
Statistics Data
BUTACLAMOL HYDROCHLORIDE
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -0.413400000000000 | 1 | 2 |
Statistics Data Visualization
BUTACLAMOL HYDROCHLORIDE
