Compound Summary
Compound Information
53464-72-5
Compound Name: | 53464-72-5 |
Compound CID: | 6917843 |
Synonyms: | 53464-72-5 8-(Diethylamino)octyl 3,4,5-trimethoxybenzoate hydrochloride TMB-8 hydrochloride TMB 8 (hydrochloride) 8-(Diethylamino)octyl-3,4,5-trimethoxybenzoate hydrochloride More... |
Iupac Name: | 8-(diethylamino)octyl 3,4,5-trimethoxybenzoate;hydrochloride |
InChI: | InChI=1S/C22H37NO5.ClH/c1-6-23(7-2)14-12-10-8-9-11-13-15-28-22(24)18-16-19(25-3)21(27-5)20(17-18)26-4;/h16-17H,6-15H2,1-5H3;1H |
InChIKey: | KFJZVXKPPQIYCG-UHFFFAOYSA-N |
Canonical Smiles: | CCN(CC)CCCCCCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC.Cl |
Isomeric Smiles: | CCN(CC)CCCCCCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC.Cl |
Molecular Weight: | 432 |
Molecular Formula: | C22H38ClNO5 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
53464-72-5
Molecular Weight: | 432 |
Molecular Formula: | C22H38ClNO5 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 6 |
Rotatable Bond Count: | 16 |
Heavy Atom Count: | 29 |
Complexity: | 388 |
Synonyms
53464-72-5
| 53464-72-5 | 53464-72-5 |
|---|---|
53464-72-5 |
8-(Diethylamino)octyl 3,4,5-trimethoxybenzoate hydrochloride |
TMB-8 hydrochloride |
TMB 8 (hydrochloride) |
8-(Diethylamino)octyl-3,4,5-trimethoxybenzoate hydrochloride |
3,4,5-Trimethoxybenzoic Acid 8-Diethylamino-n-octyl Ester Hydrochloride |
TMB 8 hydrochloride |
TMB-8, Hydrochloride |
MLS002153307 |
ACMC-1B069 |
SCHEMBL5682553 |
CHEMBL1256666 |
8-(N,N-Diethylamino)-octyl-3,4,5-trimethoxybenzoate, HCl |
REGID_for_CID_6917843 |
Tox21_500022 |
MFCD00012502 |
NSC379318 |
AKOS015888376 |
CCG-221326 |
LP00022 |
MCULE-2208552656 |
NSC-379318 |
NCGC00093545-01 |
NCGC00260707-01 |
AS-71106 |
SMR001230723 |
DB-052340 |
EU-0100022 |
FT-0614162 |
SR-01000075348 |
SR-01000075348-1 |
8-(Diethylamino)octyl-3,4,5-trimethoxybenzoate hydrochloride, 97% |
8-(N,N-diethylamino)octyl 3,4,5-trimethoxybenzoate hydrochloride |
Experimental Data
53464-72-5
| 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 | -3 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
53464-72-5
Statistics Data
53464-72-5
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -3 | 1 | 1 |
Statistics Data Visualization
53464-72-5
