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6329-61-9 | Decahydroisoquinoline
CAS No: 6329-61-9 Catalog No: AG003P99 MDL No:MFCD00012096
Product Description
Catalog Number:
AG003P99
Chemical Name:
Decahydroisoquinoline
CAS Number:
6329-61-9
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD00012096
IUPAC Name:
1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
InChI:
InChI=1S/C9H17N/c1-2-4-9-7-10-6-5-8(9)3-1/h8-10H,1-7H2
InChI Key:
NENLYAQPNATJSU-UHFFFAOYSA-N
SMILES:
C1CCC2C(C1)CNCC2
EC Number:
228-702-4
NSC Number:
43479
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Protic ionic liquids based on decahydroisoquinoline: lost superfragility and ionicity-fragility correlation. | The journal of physical chemistry. B 20120112 |
| Physiology and pathology of calcium signaling in the brain. | Frontiers in pharmacology 20120101 |
| Essential structure of opioid κ receptor agonist nalfurafine for binding to κ receptor 1: synthesis of decahydroisoquinoline derivatives and their pharmacologies. | Chemical & pharmaceutical bulletin 20120101 |
| Sulfinylated azadecalins act as functional mimics of a pollen germination stimulant in Arabidopsis pistils. | The Plant journal : for cell and molecular biology 20111201 |
| Remodelling of the natural product fumagillol employing a reaction discovery approach. | Nature chemistry 20111201 |
| Drug discovery using chemical systems biology: weak inhibition of multiple kinases may contribute to the anti-cancer effect of nelfinavir. | PLoS computational biology 20110401 |
| Amygdalar glutamatergic neuronal systems play a key role on the hibernating state of hamsters. | BMC neuroscience 20110101 |
| Molecular Basis for Drug Resistance in HIV-1 Protease. | Viruses 20101101 |
| Straightforward assembly of the octahydroisoquinoline core of morphinan alkaloids. | Organic letters 20100521 |
| Diastereoselective synthesis of a highly functionalized angularly substituted cis-perhydroisoquinoline-3,6-dione via organoiron. | The Journal of organic chemistry 20100305 |
| Decahydroisoquinoline derivatives as novel non-peptidic, potent and subtype-selective somatostatin sst(3) receptor antagonists. | Bioorganic & medicinal chemistry letters 20100301 |
| Abundant lattice inclusion phenomenon with sterically hindered and inherently shape-selective tetraarylpyrenes. | The Journal of organic chemistry 20091120 |
| Drug-resistant molecular mechanism of CRF01_AE HIV-1 protease due to V82F mutation. | Journal of computer-aided molecular design 20090501 |
| 1H-Pyrazolo[3,4-g]hexahydro-isoquinolines as selective glucocorticoid receptor antagonists with high functional activity. | Bioorganic & medicinal chemistry letters 20080215 |
| 2-Benzenesulfonyl-8a-benzyl-hexahydro-2H-isoquinolin-6-ones as selective glucocorticoid receptor antagonists. | Bioorganic & medicinal chemistry letters 20071015 |
| Subtype selectivity and flexibility of ionotropic glutamate receptors upon antagonist ligand binding. | Organic & biomolecular chemistry 20060321 |
| Dielectric and shear mechanical alpha and beta relaxations in seven glass-forming liquids. | The Journal of chemical physics 20051215 |
| Two secondary modes in decahydroisoquinoline: which one is the true Johari Goldstein process? | The Journal of chemical physics 20050615 |
| Locomotor activity detects subunit-selective effects of agonists and decahydroisoquinoline antagonists at AMPA/kainic acid ionotropic glutamate receptors in adult rats. | Psychopharmacology 20050401 |
| Differential modulation of microglia superoxide anion and thromboxane B2 generation by the marine manzamines. | BMC pharmacology 20050101 |
| Pharmacological characterization of glutamatergic agonists and antagonists at recombinant human homomeric and heteromeric kainate receptors in vitro. | Neuropharmacology 20040501 |
| Rhodium-catalyzed anti-Markovnikov hydroamination of vinylarenes. | Journal of the American Chemical Society 20030514 |
| [Synthetic study of biologically important nitrogen containing natural products: development of new methodology and design of leading compounds for new pharmaceuticals]. | Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20030401 |
| CYP3A4-mediated hepatic metabolism of the HIV-1 protease inhibitor saquinavir in vitro. | Xenobiotica; the fate of foreign compounds in biological systems 20020101 |
| Ring closing metathesis mediated synthesis of 4a-aryloxodecahydroisoquinolines, intermediates in the preparation of novel opiates. | Organic letters 20011101 |
| Inhibitors of AMPA and kainate receptors. | Current medicinal chemistry 20010901 |
| Role of AMPA and GluR5 kainate receptors in the development and expression of amygdala kindling in the mouse. | Neuropharmacology 20010101 |
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