Ketcher 12121716212D 1   1.00000     0.00000     0

 28 30  0     0  0            999 V2000
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   -3.5708   -2.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8388   -1.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8388   -2.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1068   -2.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9729   -1.2578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9729   -3.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9729   -4.2578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1068   -1.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7593   -1.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6252    0.2421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7593   -0.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6252   -1.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4912   -1.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3574   -1.7578    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
    2.4912   -0.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3574    0.2421    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7047   -3.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7047   -4.2578    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5708   -1.7578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4367   -1.2578    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7047   -0.2578    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4368   -3.2578    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
    0.7593   -3.2578    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
    1.6252   -2.7580    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
    1.6252    1.2421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1068    0.2421    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
    2.4913    1.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 20  2  0     0  0
  1  3  1  0     0  0
 20  2  1  0     0  0
  2 18  2  0     0  0
 18  4  1  0     0  0
  6  3  1  0     0  0
  3  4  2  0     0  0
  4  7  1  0     0  0
  6  9  1  0     0  0
  7  5  1  0     0  0
  5  9  2  0     0  0
  7  8  2  0     0  0
  9 10  1  0     0  0
 12 10  2  0     0  0
 10 13  1  0     0  0
 11 12  1  0     0  0
 11 16  2  0     0  0
 13 14  2  0     0  0
 14 16  1  0     0  0
 14 15  1  0     0  0
 16 17  1  0     0  0
 18 19  1  0     0  0
 20 21  1  0     0  0
  1 22  1  0     0  0
  2 23  1  0     0  0
  5 24  1  0     0  0
 13 25  1  0     0  0
 11 26  1  0     0  0
 12 27  1  0     0  0
 26 28  1  0     0  0
M  END
> <ID>
CHEBI:138730

> <NAME>
3'-methoxyflavones

> <DEFINITION>
Any methoxyflavone with a methoxy substituent at position 3'.

> <STAR>
3

> <SYNONYM>
a 3'-methoxyflavone; 3'-methoxyflavones; 3'-methoxyflavone

> <FORMULA>
C16H3O3R9

> <MASS>
243.194

> <MONOISOTOPIC_MASS>
243.00822

> <CHARGE>
0

> <SMILES>
C1(=C(C(=C(C2=C1OC(=C(C2=O)*)C3=C(C(=C(C(=C3*)*)*)OC)*)*)*)*)*

> <METACYC_ACCESSION>
3-O-methylflavonoids

$$$$