-OEChem-10281115202D

 11 11  0     1  0  0  0  0  0999 V2000
    7.0292   -7.0167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6042   -7.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3208   -6.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3208   -5.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6042   -7.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8917   -6.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6042   -5.3667    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.8917   -5.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3167   -8.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8917   -8.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5792   -4.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  2  3  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  4  7  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6  8  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  1  1  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
24887985

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
Sigma-Aldrich

> <PUBCHEM_EXT_DATASOURCE_REGID>
82569_FLUKA

> <PUBCHEM_SUBSTANCE_SYNONYM>
(+)-Pulegone
(R)-2-Isopropylidene-5-methylcyclohexanone
(R)-p-Menth-4(8)-en-3-one
82569_FLUKA

> <PUBCHEM_XREF_EXT_ID>
82569_FLUKA

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.sigmaaldrich.com?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.sigmaaldrich.com/catalog/search/ProductDetail/FLUKA/82569?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_CID_ASSOCIATIONS>
442495  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
7  11  5

$$$$