Mol:Rhynchophylline

 
  ACD/Labs12010713242D 
 
 29 32  0  0  1  0  0  0  0  0  1 V2000 
   25.4764   -4.4147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   25.4764   -5.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   24.3245   -3.7497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   24.3245   -6.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   23.1727   -4.4147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   23.1727   -5.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.7801   -4.4147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.7801   -5.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   26.6282   -6.4097    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
   30.0837   -3.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   30.0837   -4.4147    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
   28.9318   -5.0797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.7801   -3.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   31.2357   -5.0797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   31.2357   -6.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   30.0837   -7.0747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   28.9320   -6.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   32.3876   -7.0747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   31.2357   -9.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   30.0839   -8.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   28.9322   -9.0698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.7804   -8.4049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   28.9324  -10.3998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   28.9318   -3.7497    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   28.5709   -6.9705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   26.6287   -9.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   33.5394   -6.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   32.3876   -8.4047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   33.5394   -9.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  3  1  2  0  0  0  0 
  4  2  2  0  0  0  0 
  5  3  1  0  0  0  0 
  6  4  1  0  0  0  0 
  6  5  2  0  0  0  0 
  7  8  1  1  0  0  0 
  9  8  1  0  0  0  0 
  2  9  1  0  0  0  0 
  2  1  1  0  0  0  0 
 11 10  1  0  0  0  0 
  7 12  1  0  0  0  0 
  7 13  1  0  0  0  0 
 15 14  1  0  0  0  0 
 11 14  1  0  0  0  0 
 12 11  1  0  0  0  0 
 17 12  1  0  0  0  0 
 15 18  1  6  0  0  0 
 16 15  1  0  0  0  0 
 20 19  2  0  0  0  0 
 17 16  1  0  0  0  0 
 16 20  1  1  0  0  0 
 21 20  1  0  0  0  0 
 22 21  1  0  0  0  0 
  7  1  1  6  0  0  0 
 13 10  1  0  0  0  0 
 21 23  2  0  0  0  0 
 12 24  1  6  0  0  0 
  8 25  2  0  0  0  0 
 26 22  1  0  0  0  0 
 18 27  1  0  0  0  0 
 19 28  1  0  0  0  0 
 28 29  1  0  0  0  0 
S  SKP  5 
ID	Rhynchophylline 
FORMULA	C22H28N2O4 
EXACTMASS	384.204907394 
AVERAGEMASS	384.46880000000004 
SMILES	COC=C(C(=O)OC)C(C(CC)4)CC([H])(N(C4)3)C(CC3)(C(=O)1)c(c2)c(ccc2)N1 
M  END