FANDOM


(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE
  DSViewer          3D                             0

 26 27  0  0  0  0  0  0  0  0999 V2000
   31.1790   23.8160   26.6670 N   0  0  0  0  0  0  0  0  0  1
   31.9470   22.8180   27.3110 C   0  0  0  0  0  0  0  0  0  2
   32.6240   21.8560   26.5370 C   0  0  0  0  0  0  0  0  0  3
   32.5390   21.9030   25.1300 C   0  0  0  0  0  0  0  0  0  4
   31.7710   22.8970   24.4920 C   0  0  0  0  0  0  0  0  0  5
   31.0870   23.8570   25.2630 C   0  0  0  0  0  0  0  0  0  6
   34.4490   21.3560   28.2120 N   0  0  0  0  0  0  0  0  0  7
   33.4580   20.7650   27.2350 C   0  0  1  0  0  0  0  0  0  8
   32.5710   19.7980   28.0550 C   0  0  0  0  0  0  0  0  0  9
   33.4920   19.3220   29.1730 C   0  0  0  0  0  0  0  0  0 10
   34.3540   20.5630   29.4840 C   0  0  0  0  0  0  0  0  0 11
   35.8280   21.1970   27.6460 C   0  0  0  0  0  0  0  0  0 12
   32.0143   22.7937   28.3986 H   0  0  0  0  0  0  0  0  0 13
   33.0718   21.1643   24.5313 H   0  0  0  0  0  0  0  0  0 14
   31.7063   22.9231   23.4042 H   0  0  0  0  0  0  0  0  0 15
   30.4898   24.6274   24.7752 H   0  0  0  0  0  0  0  0  0 16
   34.0003   20.1955   26.4802 H   0  0  0  0  0  0  0  0  0 17
   31.7030   20.3172   28.4613 H   0  0  0  0  0  0  0  0  0 18
   32.2396   18.9602   27.4415 H   0  0  0  0  0  0  0  0  0 19
   32.9173   19.0180   30.0479 H   0  0  0  0  0  0  0  0  0 20
   34.1127   18.4907   28.8386 H   0  0  0  0  0  0  0  0  0 21
   35.3480   20.2570   29.8102 H   0  0  0  0  0  0  0  0  0 22
   33.8830   21.1608   30.2643 H   0  0  0  0  0  0  0  0  0 23
   36.5564   21.6184   28.3387 H   0  0  0  0  0  0  0  0  0 24
   35.8916   21.7185   26.6909 H   0  0  0  0  0  0  0  0  0 25
   36.0400   20.1383   27.4963 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>
1OL8_NCT_A_1207

> <ChemCompId>
NCT

> <PdbId>
1OL8

> <ChainId>
A

> <ResidueNumber>
1207

> <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

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