
 OpenBabel04291915413D

 30 32  0  0  0  0  0  0  0  0999 V2000
    5.0024    0.6954   -2.3205 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3314    1.5337   -3.1270 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9885    1.5348   -3.1267 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3166    0.6976   -2.3199 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0380   -0.2039   -1.4527 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4238   -0.9692   -0.7152 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4820   -0.2050   -1.4530 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0963    0.5603   -2.1905 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2035   -1.1065   -0.5858 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2689   -2.7545    1.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5676   -2.7556    1.0006 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2174   -1.9459    0.2203 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5465   -1.1075   -0.5862 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6614   -1.9470    0.2200 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2757   -1.1817   -0.5175 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3355   -2.7892    1.0301 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0178    0.6986   -2.3196 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3453    0.6943   -2.3208 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0668   -0.2071   -1.4536 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4526   -0.9725   -0.7161 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4158   -0.2082   -1.4540 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0539    2.4340   -3.9945 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2815    2.4330   -3.9948 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3799    3.2761   -4.8047 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4860    0.0520   -1.7005 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0595   -3.3702    1.5918 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0628   -0.4641   -1.2062 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2725   -2.7899    1.0299 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8840   -0.7931   -0.8913 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8487    3.8603   -5.3676 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1 18  1  0  0  0  0
  1 25  1  0  0  0  0
  2 22  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3 10  1  0  0  0  0
  4 17  1  0  0  0  0
  4  5  1  0  0  0  0
  5  7  1  0  0  0  0
  5  6  2  0  0  0  0
  7  9  1  0  0  0  0
  7  8  2  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
 11 12  1  0  0  0  0
 11 26  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 27  1  0  0  0  0
 14 16  1  0  0  0  0
 14 15  2  0  0  0  0
 16 28  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 21  1  0  0  0  0
 19 20  2  0  0  0  0
 21 29  1  0  0  0  0
 22 24  1  0  0  0  0
 22 23  2  0  0  0  0
 24 30  1  0  0  0  0
M  END
>  <SKU>
A13281

>  <Product Name>
Pyrroloquinoline quinone

>  <CAS>
72909-34-3

>  <M.Wt>
330.20604

>  <Formula>
C14H6N2O8

>  <Synonyms>
PQQ

>  <URL>
https://www.adooq.com/pyrroloquinoline-quinone.html

$$$$
