ChEBI
  Marvin  05080615362D          

 12 13  0  0  0  0            999 V2000
   11.7236   -8.0943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0091   -7.6818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0091   -6.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7236   -6.4442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4380   -6.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1525   -6.4442    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.8670   -6.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8670   -7.6818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4380   -7.6818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1525   -8.0943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1525   -8.9193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5815   -8.0943    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  2  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
 10  9  1  0  0  0  0
  8 10  1  0  0  0  0
 11 10  2  0  0  0  0
 12  8  1  0  0  0  0
M  END
> <ID>
CHEBI:16569

> <NAME>
3-hydroxyquinolin-4(1H)-one

> <DEFINITION>
A quinoline having the keto group at the 4-position and an additional hydroxy substituent at the 3-position.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:11801; CHEBI:1514

> <SYNONYM>
3-hydroxy-1H-quinolin-4-one; 3-Hydroxy-1H-quinolin-4-one

> <IUPAC_NAME>
3-hydroxyquinolin-4(1H)-one

> <FORMULA>
C9H7NO2

> <MASS>
161.15742

> <MONOISOTOPIC_MASS>
161.04768

> <CHARGE>
0

> <SMILES>
Oc1c[nH]c2ccccc2c1=O

> <INCHI>
InChI=1S/C9H7NO2/c11-8-5-10-7-4-2-1-3-6(7)9(8)12/h1-5,11H,(H,10,12)

> <INCHIKEY>
BHTNYVRPYQQOMJ-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1526157

> <KEGG_COMPOUND_ACCESSION>
C11503

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