null
  CDK     0224162205
null
 32 34  0  0  0  0  0  0  0  0999 V2000
   -2.3569    1.2656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6425    0.8531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6425    0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280   -0.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280   -1.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2135   -1.6219    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5009   -1.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5009   -0.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2135    0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0843    0.1990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7686    0.9612    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9093    0.1990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4927   -0.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4927   -1.2094    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.9093   -1.7928    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0843   -1.7928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2250   -2.5550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7228   -3.2095    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9049   -3.1018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0385   -3.9717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8564   -4.0794    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5363   -4.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8520   -5.3884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3498   -6.0429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5318   -5.9352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2161   -5.1730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7183   -4.5185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2549   -1.5251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2250    0.9612    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0430    1.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7228    1.6157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0385    2.3779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  4  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  7  2  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9  4  1  0  0  0  0 
  8 10  1  0  0  0  0 
 10 11  2  0  0  0  0 
 10 12  1  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16  7  1  0  0  0  0 
 15 17  1  1  0  0  0 
 17 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
 18 20  1  0  0  0  0 
 20 21  2  0  0  0  0 
 20 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
 25 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 22  1  0  0  0  0 
 14 28  1  6  0  0  0 
 12 29  1  0  0  0  0 
 29 30  1  6  0  0  0 
 29 31  1  0  0  0  0 
 31 32  1  0  0  0  0 
M  END
> <ID>
CHEBI:95753

> <NAME>
LSM-7132

> <STAR>
2

> <FORMULA>
C24H35N3O5

> <MASS>
445.553

> <MONOISOTOPIC_MASS>
445.25767

> <CHARGE>
0

> <SMILES>
CC=CC1=CN=C2C(=C1)C(=O)N(C[C@@H]([C@H](O2)CN(C)C(=O)C3CCOCC3)C)[C@@H](C)CO

> <INCHI>
InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/t16-,17-,21+/m0/s1

> <INCHIKEY>
WESXQGCLCDUYEJ-XGHQBKJUSA-N

> <LINCS_ACCESSION>
LSM-7132

$$$$