-OEChem-07221113212D

 11  9  0     0  0  0  0  0  0999 V2000
    4.5742    0.0000    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    0.8244    0.7798    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8142   -0.0599    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4352   -0.0599    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1653   -0.0210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3295    0.6230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2396   -0.0569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8244   -0.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5742   -0.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4352    0.9898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4352   -0.9898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  8  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
M  CHG  2   1  -1   4   1
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
24864895

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
Sigma-Aldrich

> <PUBCHEM_EXT_DATASOURCE_REGID>
403245_ALDRICH

> <PUBCHEM_SUBSTANCE_SYNONYM>
(3-Carboxypropyl)trimethylammonium chloride
403245_ALDRICH
Deoxycarnitine hydrochloride
gamma-Butyrobetaine hydrochloride

> <PUBCHEM_XREF_EXT_ID>
403245_ALDRICH

> <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/ALDRICH/403245?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_CID_ASSOCIATIONS>
22620  1
134  2
313  2

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$