CDK     1018121545

 16 17  0  0  0  0  0  0  0  0999 V2000
    6.4542   -6.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6292   -6.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -7.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8583   -6.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6917   -7.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1000   -6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6833   -6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2208   -7.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6375   -8.1500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1042   -8.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0917   -5.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2167   -6.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4000   -7.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9167   -5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3917   -6.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9792   -6.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0 
  3  1  2  0  0  0  0 
  4  1  1  0  0  0  0 
  5  3  1  0  0  0  0 
  6  5  2  0  0  0  0 
  7  4  2  0  0  0  0 
  8  2  1  0  0  0  0 
  9  8  1  0  0  0  0 
 10  5  1  0  0  0  0 
 11  7  1  0  0  0  0 
 12  2  2  0  0  0  0 
 13  8  2  0  0  0  0 
 14 11  1  0  0  0  0 
 15 12  1  0  0  0  0 
 16 15  2  0  0  0  0 
  7  6  1  0  0  0  0 
 13 16  1  0  0  0  0 
M  END
> <ID>
CHEBI:70632

> <NAME>
2',3-dihydroxy-5-methoxybiphenyl

> <DEFINITION>
A natural product found in Rhaphiolepis indica var. tashiroi. 

> <STAR>
2

> <SYNONYM>
3-(2-hydroxyphenyl)-5-methoxyphenol

> <FORMULA>
C13H12O3

> <MASS>
216.23260

> <MONOISOTOPIC_MASS>
216.07864

> <CHARGE>
0

> <SMILES>
COc1cc(O)cc(c1)-c1ccccc1O

> <INCHI>
InChI=1S/C13H12O3/c1-16-11-7-9(6-10(14)8-11)12-4-2-3-5-13(12)15/h2-8,14-15H,1H3

> <INCHIKEY>
XBBDTINCHJPZGW-UHFFFAOYSA-N

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