
 OpenBabel04291915393D

 20 22  0  0  0  0  0  0  0  0999 V2000
    0.9735    2.6538   -6.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3164    2.6538   -6.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9878    2.1956   -5.1142 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3308    2.1956   -5.1142 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0022    2.6538   -6.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3308    3.1120   -7.2521 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3606    1.7676   -4.1156 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0022    1.7374   -4.0452 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1982    0.3931   -0.9087 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8697    0.8512   -1.9777 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2126    0.8512   -1.9777 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8841    1.3094   -3.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1117    1.3094   -3.0466 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2568    1.7374   -4.0452 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0827    2.8591   -6.6622 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8324    3.0059   -7.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0342    2.6538   -6.1831 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3308    3.5185   -8.2006 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3537    1.2033   -2.7991 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7286    0.4992   -1.1562 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  9  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6 18  1  0  0  0  0
  8 14  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 19  1  0  0  0  0
 11 12  1  0  0  0  0
 11 20  1  0  0  0  0
 12 14  1  0  0  0  0
 12 13  2  0  0  0  0
M  END
>  <SKU>
A12198

>  <Product Name>
Angelicin

>  <CAS>
523-50-2

>  <M.Wt>
186.16354

>  <Formula>
C11H6O3

>  <Synonyms>
NSC 404563, Bakuchicin

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

$$$$
