CDK     1018121544

 25 28  0  0  0  0  0  0  0  0999 V2000
    4.9042   -4.0209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9084   -3.1959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1875   -4.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4750   -4.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1917   -2.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4750   -3.1959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6209   -2.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6167   -4.4375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.3375   -3.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6167   -1.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3334   -4.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7625   -2.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7625   -4.4334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1875   -5.2584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1917   -1.9584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0500   -2.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3375   -1.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0542   -1.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0542   -3.1959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0542   -4.0209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9084   -1.5500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7584   -1.9667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7625   -5.2542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7625   -1.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6138   -5.2625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0 
  3  1  1  0  0  0  0 
  4  3  1  0  0  0  0 
  5  2  1  0  0  0  0 
  6  5  1  0  0  0  0 
  7  2  1  0  0  0  0 
  8  1  1  0  0  0  0 
  9 11  1  0  0  0  0 
 10  7  1  0  0  0  0 
 11  8  1  0  0  0  0 
 12  6  2  0  0  0  0 
 13  4  2  0  0  0  0 
 14  3  2  0  0  0  0 
 15  5  2  0  0  0  0 
 16  9  1  0  0  0  0 
 17 10  2  0  0  0  0 
 18 16  2  0  0  0  0 
 19 12  1  0  0  0  0 
 20 13  1  0  0  0  0 
 21 10  1  0  0  0  0 
 22 12  1  0  0  0  0 
 23 13  1  0  0  0  0 
 24 18  1  0  0  0  0 
  9  7  2  0  0  0  0 
  4  6  1  0  0  0  0 
 20 19  2  0  0  0  0 
 17 18  1  0  0  0  0 
  8 25  1  1  0  0  0 
M  END
> <ID>
CHEBI:70059

> <NAME>
Landomycinone

> <DEFINITION>
A natural product found in Streptomyces cyanogenus. 

> <STAR>
2

> <SYNONYM>
(6R)-1,6,8,11-Tetrahydroxy-3-methyl-5,6-dihydro-7,12-tetraphenedion

> <FORMULA>
C19H14O6

> <MASS>
338.31090

> <MONOISOTOPIC_MASS>
338.07904

> <CHARGE>
0

> <SMILES>
Cc1cc(O)c2c(C[C@@H](O)C3=C2C(=O)c2c(O)ccc(O)c2C3=O)c1

> <INCHI>
InChI=1S/C19H14O6/c1-7-4-8-6-12(23)16-17(13(8)11(22)5-7)19(25)15-10(21)3-2-9(20)14(15)18(16)24/h2-5,12,20-23H,6H2,1H3/t12-/m1/s1

> <INCHIKEY>
DMGKSWBAQZKXEJ-GFCCVEGCSA-N

> <PUBMED_CITATION>
21188999

$$$$