Compound Summary
Compound Information
ISOETHARINE MESYLATE
Compound Name: | ISOETHARINE MESYLATE |
Compound CID: | 23702 |
Synonyms: | ISOETHARINE MESYLATE Isoetharine mesylate salt 7279-75-6 Isotharine mesylate Isoetharine (mesylate) More... |
Iupac Name: | 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;methanesulfonic acid |
InChI: | InChI=1S/C13H21NO3.CH4O3S/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9;1-5(2,3)4/h5-8,10,13-17H,4H2,1-3H3;1H3,(H,2,3,4) |
InChIKey: | SOYAGMVKMXZVNZ-UHFFFAOYSA-N |
Canonical Smiles: | CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C.CS(=O)(=O)O |
Isomeric Smiles: | CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C.CS(=O)(=O)O |
Molecular Weight: | 335.42 |
Molecular Formula: | C14H25NO6S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
ISOETHARINE MESYLATE
Molecular Weight: | 335.42 |
Molecular Formula: | C14H25NO6S |
Hydrogen Bond Donor Count: | 5 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 22 |
Complexity: | 315 |
Synonyms
ISOETHARINE MESYLATE
| ISOETHARINE MESYLATE | ISOETHARINE MESYLATE |
|---|---|
ISOETHARINE MESYLATE |
Isoetharine mesylate salt |
7279-75-6 |
Isotharine mesylate |
Isoetharine (mesylate) |
Isoetarine mesilate |
4-1-HYDROXY-2-(1-METHYLETHYLAMINO)BUTYL-1,2-BENZENEDIOL METHANESULFONATE |
MLS000069674 |
Isoetarine mesilate; Isoetharine mesylate |
SMR000058457 |
4-1-hydroxy-2-(propan-2-ylamino)butylbenzene-1,2-diol;methanesulfonic acid |
C13H21NO3.CH4O3S |
Isoetharine mesylate (USP) |
SR-01000000183 |
Bronkometer (TN) |
NCGC00017071-01 |
CAS-7279-75-6 |
Prestwick_1003 |
Opera_ID_1465 |
DSSTox_CID_25571 |
DSSTox_RID_80968 |
DSSTox_GSID_45571 |
MLS001146940 |
SCHEMBL212005 |
REGID_for_CID_23702 |
CHEMBL1201153 |
DTXSID2045571 |
5-Propylthiophene-3-carboxylicacid |
HMS1570E20 |
HMS2093J16 |
HMS2097E20 |
HMS2230F06 |
HMS3262G03 |
HMS3714E20 |
Pharmakon1600-01505977 |
Tox21_110768 |
Tox21_500671 |
2481AH |
MFCD00133422 |
NSC759286 |
4-1-Hydroxy-2-(1-methylethyl)aminobutyl-1,2-benzenediol mesylate salt |
AKOS015889242 |
CCG-213584 |
LP00671 |
NSC-759286 |
NCGC00016157-02 |
NCGC00094032-01 |
NCGC00261356-01 |
EU-0100671 |
SW197083-3 |
D04626 |
I 3639 |
SR-01000000183-2 |
SR-01000000183-4 |
SR-01000000183-6 |
4-(1-hydroxy-2-(isopropylamino)butyl)benzene-1,2-diol methanesulfonate |
4-1-Hydroxy-2-(1-methylethyl)aminobutyl-1,2-benzenediol mesylate |
Experimental Data
ISOETHARINE MESYLATE
| 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 | 0 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
ISOETHARINE MESYLATE
Statistics Data
ISOETHARINE MESYLATE
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0 | 1 | 1 |
Statistics Data Visualization
ISOETHARINE MESYLATE
