
 OpenBabel04291915333D

 30 31  0  0  1  0  0  0  0  0999 V2000
    0.9708   -0.0527    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4528   -0.0527    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0666    0.5327   -0.8076 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1273   -0.6959    1.0551 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5143   -0.6959    1.0551 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0083   -1.4653    2.2214 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3002   -1.5975    2.4218 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7657   -2.3235    3.5203 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8335   -2.9248    4.4298 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9599   -3.9159    3.6781 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.1387   -2.4640    3.7333 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9364   -1.9494    2.9550 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2249   -3.2140    2.6161 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7385   -3.7891    5.7375 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5143   -0.6949    1.0557 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2386   -0.9922    1.5063 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8294   -0.3540    0.5408 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5649   -1.1279    1.7121 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6141   -0.6081    0.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6141   -0.5042   -0.8223 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6141    0.9544    0.1398 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8710    0.3111    1.1151 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8710   -1.1475    0.1529 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2182   -2.1649    4.8642 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3888   -4.8123    3.8013 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6871   -2.3282    2.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2693   -3.0354    2.9248 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2973    0.3529    1.0549 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1887   -0.6602    0.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1738   -0.7351    1.1180 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  2  4  1  0  0  0  0
  2  3  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 22  1  0  0  0  0
  5 23  1  0  0  0  0
  6  7  2  0  0  0  0
  6 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 11  1  0  0  0  0
  9 14  1  0  0  0  0
  9 10  1  0  0  0  0
  9 24  1  0  0  0  0
 10 13  1  0  0  0  0
 10 11  1  0  0  0  0
 10 25  1  0  0  0  0
 11 12  2  0  0  0  0
 13 26  1  0  0  0  0
 13 27  1  0  0  0  0
 14 15  1  0  0  0  0
 15 28  1  0  0  0  0
 15 29  1  0  0  0  0
 16 18  1  0  0  0  0
 16 17  2  0  0  0  0
 18 30  1  0  0  0  0
M  END
>  <SKU>
A10018

>  <Product Name>
7-Aminocephalosporanic acid

>  <CAS>
957-68-6

>  <M.Wt>
272.27768

>  <Formula>
C10H12N2O5S

>  <Synonyms>
7-ACA 

>  <URL>
https://www.adooq.com/7-aminocephalosporanic-acid.html

$$$$
