
 OpenBabel04291915413D

 36 38  0  0  0  0  0  0  0  0999 V2000
   -3.4969    0.9639    1.3745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6495    1.4987    2.1372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4453    2.2452    3.1991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1421    2.5347    3.6089 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0559    2.0308    2.8903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9103    2.2853    3.2505 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9750    0.1859    0.2683 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0675   -0.4238   -0.6006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5152   -1.1522   -1.6363 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6425   -1.7385   -2.4718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0901   -2.4668   -3.5074 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2175   -3.0531   -4.3430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7472   -0.2817   -0.4006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2976    0.4500    0.6398 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5684    2.7663    3.9422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3597    3.5293    5.0275 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4042    4.0138    5.7186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6574    3.7354    5.3245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8661    2.9725    4.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8216    2.4879    3.5481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1871    4.8072    6.8471 N   0  3  0  0  0  0  0  0  0  0  0  0
   -5.0818    5.0528    7.1947 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1994    5.2769    7.5169 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.9016    0.3463    2.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9032    1.7758    1.0094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6126    1.2847    1.8343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9890    3.0941    4.4045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5298   -1.2614   -1.7900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6279   -1.6293   -2.3181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1048   -2.5760   -3.6612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9075   -3.6189   -5.1485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9065    0.8590    1.2228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3966    3.7432    5.3303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4601    4.1078    5.8556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8292    2.7585    3.9364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9820    1.9016    2.7141 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  1 24  1  0  0  0  0
  1 25  1  0  0  0  0
  2  3  2  0  0  0  0
  2 26  1  0  0  0  0
  3 15  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 27  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 13  1  0  0  0  0
  9 10  1  0  0  0  0
  9 28  1  0  0  0  0
 10 11  2  0  0  0  0
 10 29  1  0  0  0  0
 11 12  1  0  0  0  0
 11 30  1  0  0  0  0
 12 13  2  0  0  0  0
 12 31  1  0  0  0  0
 13 14  1  0  0  0  0
 14 32  1  0  0  0  0
 15 16  2  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 16 33  1  0  0  0  0
 17 21  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 34  1  0  0  0  0
 19 20  2  0  0  0  0
 19 35  1  0  0  0  0
 20 36  1  0  0  0  0
 21 23  1  0  0  0  0
 21 22  2  0  0  0  0
M  CHG  2  21   1  23  -1
M  END
>  <SKU>
A13560

>  <Product Name>
Icilin

>  <CAS>
36945-98-9

>  <M.Wt>
311.29212

>  <Formula>
C16H13N3O4

>  <Synonyms>
AG 3-5

>  <URL>
https://www.adooq.com/icilin.html

$$$$
