Marvin  10180717432D          

  9  8  0  0  1  0            999 V2000
   -1.6671    0.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9526   -0.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2382    0.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4763   -0.1833    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.1908    0.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1908    1.0542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3816   -0.1833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4763   -1.0083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9053   -0.1833    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  1  1  0  0  0  0
  4  8  1  1  0  0  0
  9  5  1  0  0  0  0
M  CHG  1   9  -1
M  END
> <ID>
CHEBI:46914

> <NAME>
L-ornithinate

> <DEFINITION>
An L-α-amino acid anion that is the conjugate base of L-ornithine.

> <STAR>
3

> <SYNONYM>
L-ornithine anion

> <IUPAC_NAME>
L-ornithinate; (2S)-2,5-diaminopentanoate

> <FORMULA>
C5H11N2O2

> <MASS>
131.15312

> <MONOISOTOPIC_MASS>
131.08260

> <CHARGE>
-1

> <SMILES>
NCCC[C@H](N)C([O-])=O

> <INCHI>
InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/p-1/t4-/m0/s1

> <INCHIKEY>
AHLPHDHHMVZTML-BYPYZUCNSA-M

> <GMELIN_REGISTRY_NUMBER>
327281

$$$$