FANDOM


1UW6_NCT_H_1206
  DSViewer          3D                             0
 
 26 27  0  0  0  0  0  0  0  0999 V2000
   81.0060  138.6790   62.7510 N   0  0  0  0  0  0  0  0  0  1
   82.1460  137.9600   62.8180 C   0  0  0  0  0  0  0  0  0  2
   82.2010  136.7960   63.5990 C   0  0  0  0  0  0  0  0  0  3
   81.0690  136.3710   64.2900 C   0  0  0  0  0  0  0  0  0  4
   79.8970  137.1260   64.1850 C   0  0  0  0  0  0  0  0  0  5
   79.8900  138.2770   63.4100 C   0  0  0  0  0  0  0  0  0  6
   83.7060  135.2370   62.4720 N   0  0  0  0  0  0  0  0  0  7
   83.4450  135.9880   63.7140 C   0  0  1  0  0  0  0  0  0  8
   84.6520  136.8510   64.0370 C   0  0  0  0  0  0  0  0  0  9
   85.7270  136.3620   63.0950 C   0  0  0  0  0  0  0  0  0 10
   85.0480  135.5460   61.9880 C   0  0  0  0  0  0  0  0  0 11
   83.6760  133.8190   62.8490 C   0  0  0  0  0  0  0  0  0 12
   83.0266  138.2846   62.2637 H   0  0  0  0  0  0  0  0  0 13
   81.0962  135.4682   64.9002 H   0  0  0  0  0  0  0  0  0 14
   78.9941  136.8123   64.7088 H   0  0  0  0  0  0  0  0  0 15
   78.9763  138.8658   63.3295 H   0  0  0  0  0  0  0  0  0 16
   83.3120  135.2711   64.5242 H   0  0  0  0  0  0  0  0  0 17
   84.4323  137.9035   63.8581 H   0  0  0  0  0  0  0  0  0 18
   84.9572  136.7142   65.0744 H   0  0  0  0  0  0  0  0  0 19
   86.2521  137.2120   62.6593 H   0  0  0  0  0  0  0  0  0 20
   86.4357  135.7347   63.6357 H   0  0  0  0  0  0  0  0  0 21
   85.6032  134.6266   61.8023 H   0  0  0  0  0  0  0  0  0 22
   84.9927  136.1295   61.0690 H   0  0  0  0  0  0  0  0  0 23
   83.8635  133.2044   61.9686 H   0  0  0  0  0  0  0  0  0 24
   82.6976  133.5728   63.2616 H   0  0  0  0  0  0  0  0  0 25
   84.4446  133.6251   63.5972 H   0  0  0  0  0  0  0  0  0 26
  1  2  4  0  0  0
  1  6  4  0  0  0
  2  3  4  0  0  0
  3  4  4  0  0  0
  3  8  1  0  0  0
  4  5  4  0  0  0
  5  6  4  0  0  0
  7  8  1  0  0  0
  7 11  1  0  0  0
  7 12  1  0  0  0
  8  9  1  0  0  0
  9 10  1  0  0  0
 10 11  1  0  0  0
  2 13  1  0  0  0
  4 14  1  0  0  0
  5 15  1  0  0  0
  6 16  1  0  0  0
  8 17  1  0  0  0
  9 18  1  0  0  0
  9 19  1  0  0  0
 10 20  1  0  0  0
 10 21  1  0  0  0
 11 22  1  0  0  0
 11 23  1  0  0  0
 12 24  1  0  0  0
 12 25  1  0  0  0
 12 26  1  0  0  0
M  END
> <InstanceId>
1UW6_NCT_H_1206
 
> <ChemCompId>
NCT
 
> <PdbId>
1UW6
 
> <ChainId>
H
 
> <ResidueNumber>
1206
 
> <Model>
1
 
> <MissingHeavyAtoms>
0
 
> <MissingHydrogenAtoms>
14
 
> <ObservedFormula>
C10 N2
 
> <SystematicName>
3-[(1R,2S)-1-methylpyrrolidin-2-yl]pyridine
 
> <Synonyms>
(S)-(-)-NICOTINE, 3-[(2S)-1-METHYL-2-PYRROLIDINYL] PYRIDINE
 
> <Type>
NON-POLYMER
 
> <Formula>
C10 H14 N2
 
> <MolecularWeight>
162.232
 
> <ModifiedDate>
2011-06-04
 
> <AmbiguousFlag>
N
 
> <InChI>
InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1
 
> <InChIKey>
SNICXCGAKADSCV-JTQLQIEISA-N
 
> <SMILES>
C[N@@]1CCC[C@H]1c2cccnc2
 
$$$$

Ad blocker interference detected!


Wikia is a free-to-use site that makes money from advertising. We have a modified experience for viewers using ad blockers

Wikia is not accessible if you’ve made further modifications. Remove the custom ad blocker rule(s) and the page will load as expected.