Ketcher 11301712102D 1   1.00000     0.00000     0

 15 14  0     0  0            999 V2000
   20.5449  -19.2860    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
   21.4110  -18.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2770  -19.2860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1430  -18.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0091  -19.2860    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.8751  -18.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7412  -19.2860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6072  -18.7861    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.4110  -17.7861    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.1430  -17.7861    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.7412  -20.2860    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.8751  -17.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7412  -17.2861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7412  -16.2860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6072  -15.7860    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  6  5  1  1     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  2  9  1  1     0  0
  4 10  2  0     0  0
  7 11  2  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
  6 12  1  0     0  0
M  CHG  2   8  -1  15   1
M  RGP  1   1   1
M  END
> <ID>
CHEBI:138482

> <NAME>
N(2)-[(3R)-hydroxy-acyl]-L-ornithine zwitterion

> <DEFINITION>
An amino acid zwitterion resulting from the transfer of a proton from the carboxy to the side-chain amino group of any N2-[(3R)-hydroxy-acyl]-L-ornithine; major species at pH 7.3.

> <STAR>
3

> <SYNONYM>
a lyso-ornithine lipid

> <FORMULA>
C8H15N2O4R

> <MASS>
203.216

> <MONOISOTOPIC_MASS>
203.10318

> <CHARGE>
0

> <SMILES>
*[C@H](CC(N[C@H](C([O-])=O)CCC[NH3+])=O)O

> <METACYC_ACCESSION>
LYSO-ORNITHINE-LIPIDS

> <PUBMED_CITATION>
15341653; 22958119

$$$$