
 OpenBabel04291915333D

 49 53  0  0  1  0  0  0  0  0999 V2000
    4.6089    7.8414   -6.4908 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7987    6.3596   -6.2107 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9319    5.9519   -5.0305 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.2156    6.5172   -4.1675 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5087    6.2162   -5.3483 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1180    7.4241   -5.6222 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8708    7.6557   -5.9007 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4667    8.9048   -6.1838 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3523    9.9143   -6.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9483   11.1633   -6.4621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3413   11.4028   -6.7501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0148    6.6462   -5.9055 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5931    9.6839   -5.9019 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8229    9.1443   -6.4718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1922   10.2860   -6.7306 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6522    5.2399   -5.3530 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0724    3.9411   -5.0586 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1868    2.9315   -5.0634 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5908    1.6825   -4.7803 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7052    0.6730   -4.7851 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1092   -0.5760   -4.5019 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3620    3.7016   -4.7706 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1111    4.5534   -4.7662 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4133    3.9455   -3.7203 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5756    2.6793   -3.4810 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9267    2.1140   -2.5083 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0889    0.8478   -2.2690 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4400    0.2824   -1.2964 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4666   -3.3806    1.1276 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1155   -2.8152    0.1550 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9533   -1.5491   -0.0844 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6022   -0.9837   -1.0570 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2191    8.1284   -7.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8926    8.4068   -5.6278 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5813    8.0323   -6.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8263    6.1688   -5.9812 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5151    5.7942   -7.0737 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6289   11.9391   -6.4584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0049   12.1522   -7.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3468    5.6738   -5.8097 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1957    3.1156   -5.2847 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5819    1.4985   -4.5590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2858    0.8571   -5.0064 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0170   -1.5930   -4.3526 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2825    4.1568   -4.6680 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7259    4.0222   -5.3220 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2821    2.6708   -1.9257 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7304   -3.3464   -0.4009 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3088   -0.9922    0.4983 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  1  0  0  0  0
  2  3  1  0  0  0  0
  2 36  1  0  0  0  0
  2 37  1  0  0  0  0
  3 23  1  0  0  0  0
  3  5  1  0  0  0  0
  3  4  1  1  0  0  0
  5  6  2  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 12  1  0  0  0  0
  8 14  1  0  0  0  0
  8  9  1  0  0  0  0
  9 13  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 10 38  1  0  0  0  0
 11 12  2  0  0  0  0
 11 39  1  0  0  0  0
 12 40  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 22  1  0  0  0  0
 18 19  1  0  0  0  0
 18 41  1  0  0  0  0
 19 20  2  0  0  0  0
 19 42  1  0  0  0  0
 20 21  1  0  0  0  0
 20 43  1  0  0  0  0
 21 22  2  0  0  0  0
 21 44  1  0  0  0  0
 22 45  1  0  0  0  0
 23 24  1  0  0  0  0
 23 46  1  0  0  0  0
 24 25  2  0  0  0  0
 24 29  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 47  1  0  0  0  0
 27 28  1  0  0  0  0
 28 32  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 48  1  0  0  0  0
 31 32  2  0  0  0  0
 31 49  1  0  0  0  0
M  END
>  <SKU>
A10172

>  <Product Name>
CAL-101 (GS-1101, Idelalisib)

>  <CAS>
870281-82-6

>  <M.Wt>
415.4230232

>  <Formula>
C22H18FN7O

>  <Synonyms>
CAL101

>  <URL>
https://www.adooq.com/cal-101-cal-101.html

$$$$
