Compound Summary
131543-23-2
Compound Information
131543-23-2
Compound Name: | 131543-23-2 |
Compound CID: | 6604176 |
Synonyms: | 131543-23-2 WIN 55212-2 mesylate WIN 55,212-2 MESYLATE (R)-(5-Methyl-3-(morpholinomethyl)-2,3-dihydro-1,4oxazino2,3,4-hiindol-6-yl)(naphthalen-1-yl)methanone methanesulfonate WIN-55212-2 Mesylate More... |
Iupac Name: | methanesulfonic acid;[(11R)-2-methyl-11-(morpholin-4-ylmethyl)-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraen-3-yl]-naphthalen-1-ylmethanone |
InChI: | InChI=1S/C27H26N2O3.CH4O3S/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28;1-5(2,3)4/h2-11,20H,12-17H2,1H3;1H3,(H,2,3,4)/t20-;/m1./s1 |
InChIKey: | FSGCSTPOPBJYSX-VEIFNGETSA-N |
Canonical Smiles: | CC1=C(C2=C3N1C(COC3=CC=C2)CN4CCOCC4)C(=O)C5=CC=CC6=CC=CC=C65.CS(=O)(=O)O |
Isomeric Smiles: | CC1=C(C2=C3N1[C@@H](COC3=CC=C2)CN4CCOCC4)C(=O)C5=CC=CC6=CC=CC=C65.CS(=O)(=O)O |
Molecular Weight: | 522.6 |
Molecular Formula: | C28H30N2O6S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
131543-23-2
Molecular Weight: | 522.6 |
Molecular Formula: | C28H30N2O6S |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 37 |
Complexity: | 772 |
Synonyms
131543-23-2
| 131543-23-2 | 131543-23-2 |
|---|---|
131543-23-2 |
WIN 55212-2 mesylate |
WIN 55,212-2 MESYLATE |
(R)-(5-Methyl-3-(morpholinomethyl)-2,3-dihydro-1,4oxazino2,3,4-hiindol-6-yl)(naphthalen-1-yl)methanone methanesulfonate |
WIN-55212-2 Mesylate |
( R)-(+)-WIN 55,212-2 mesylate |
(R)-(+)-WIN 55212 |
WIN 55,212-2 (Mesylate) |
UNII-2J851TP7VJ |
2J851TP7VJ |
Methanone, (3R)-2,3-dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo1,2,3-de-1,4-benzoxazin-6-yl-1-naphthalenyl-, methanesulfonate (1:1) |
(3R)-2,3-dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo1,2,3-de-1,4-benzoxazin-6-yl-1-naphthalenyl-methanone, monomethanesulfonate |
SR-01000076200 |
(R)-(+)-2,3-dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo1,2,3-de-1,4-benzoxazin-6-yl-1-naphthalenylmethanone mesylate |
Methanone, ((3R)-2,3-dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo(1,2,3-de)-1,4-benzoxazin-6-yl)-1-naphthalenyl-, methanesulfonate (1:1) |
NCGC00016210-01 |
Lopac-W-102 |
(R)-(+)-WIN 55,212-2 mesylate salt |
WIN55212-2 mesylate |
WIN-55212-2 mesilate |
MLS000860027 |
BML2-C07 |
SCHEMBL1517636 |
CHEMBL1222317 |
WIN 55, 212-2 mesylate |
1-naphthalenyl)methanone mesylate |
AMY7834 |
AOB4577 |
DTXSID50424974 |
C27H26N2O3.CH4O3S |
HMS2236O05 |
HMS3267A16 |
HMS3402M20 |
HMS3650K10 |
(R)-(5-Methyl-3-(morpholinomethyl)-2,3-dihydro-1,4oxazino-2,3,4-hiindol-6-yl)(naphthalen-1-yl)methanone methanesulfonate |
BCP02715 |
s8017 |
AKOS015998626 |
CS-0517 |
LP01278 |
(+)-WIN 55,212-2 (mesylate) |
(R)-(+)-Win 55212-2 mesylate |
NCGC00094513-01 |
AC-27750 |
AS-75227 |
HY-13291 |
SMR000326885 |
EU-0101278 |
W-102 |
Y0477 |
543W232 |
J-502109 |
SR-01000076200-1 |
SR-01000076200-4 |
WIN 55,212-2 MESYLATE in Methanol (1000ug/ml) |
(R)-(+)-WIN 55,212-2 mesylate salt, >=98% (HPLC) |
(11R)-2-methyl-11-(morpholin-4-yl)methyl-3-(naphthalene-1-carbonyl)-9-oxa-1-azatricyclo6.3.1.0?,(1)(2)dodeca-2,4,6,8(12)-tetraene; methanesulfonic acid |
(R)-(+)-(2,3-Dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo(1,2,3-de)-1,4-benzoxazin-6-yl)-1-napthalenylmethanone |
(R)-(+)-2,3-Dihydro-5-methyl-3(morpholinyl)methylpyrrolo1,2,3-de-1,4-benzoxazinyl-( |
(R)-(5-methyl-3-(morpholinomethyl)-2,3-dihydro-1,4oxazino2,3,4-hiindol-6-yl)(naphthalen-1-yl)methanone mesylate |
(R)-5-Methyl-3-(morpholinomethyl)-6-(1-naphthylcarbonyl)-2,3-dihydro-1,4oxazino2,3,4-hiindole Methanesulfonate |
Methanesulfonic acid--{(3R)-5-methyl-3-(morpholin-4-yl)methyl-2,3-dihydro1,4oxazino2,3,4-hiindol-6-yl}(naphthalen-1-yl)methanone (1/1) |
methanesulfonic acid;(11R)-2-methyl-11-(morpholin-4-ylmethyl)-9-oxa-1-azatricyclo6.3.1.04,12dodeca-2,4(12),5,7-tetraen-3-yl-naphthalen-1-ylmethanone |
Experimental Data
131543-23-2
| 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 | 33.000000000000000 | umol/L | 8.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
131543-23-2
Statistics Data
131543-23-2
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 8.000000000000000 | 1 | 1 |
Statistics Data Visualization
131543-23-2
