Mrv0541 04111409152D          

 17 16  0  0  0  0            999 V2000
   12.7063   -1.5911    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
   13.4208   -2.0036    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1352   -1.5911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8497   -2.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5642   -1.5911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2786   -2.0036    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9931   -1.5911    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   17.7076   -2.0036    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.4221   -1.5911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1365   -2.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8510   -1.5911    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   16.9931   -0.7661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2066   -2.3880    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.8497   -2.8286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1352   -3.2411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4208   -2.8286    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
   14.1352   -4.0661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  7 12  2  0  0  0  0
  7 13  1  0  0  0  0
  4 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
M  CHG  2  11   1  13  -1
M  RGP  1  16   2
M  END
> <ID>
CHEBI:78197

> <NAME>
1-alkyl-2-acyl-glycero-3-phosphoethanolamine zwitterion

> <DEFINITION>
An alkyl,acyl-glycero-3-phosphoethanolamine zwitterion in which an unspecified alkyl group is located at position sn-1 or sn-3 and an unspecified acyl group is located at position sn-2.

> <STAR>
3

> <SYNONYM>
1-alkyl-2-acyl-glycero-3-phosphoethanolamine

> <FORMULA>
C6H12NO7PR2

> <MASS>
241.136

> <MONOISOTOPIC_MASS>
241.03514

> <CHARGE>
0

> <SMILES>
[NH3+]CCOP([O-])(=O)OCC(CO[*])OC([*])=O

$$$$