(2S,6S)-2,6-diazaniumylheptanedioate
  Marvin  03141109542D          

 13 12  0  0  0  0            999 V2000
    1.4289   -0.1904    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1434    0.2221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.2221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.0154    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.1434    1.0471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -0.1904    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.1904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.2221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -0.1904    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1434    0.2221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.0154    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.1434    1.0471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579   -0.1904    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  1  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  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
  9 11  1  6  0  0  0
 10 12  2  0  0  0  0
 10 13  1  0  0  0  0
M  CHG  4   4   1   6  -1  11   1  13  -1
M  END
> <ID>
CHEBI:57609

> <NAME>
(2S,6S)-2,6-diaminopimelic acid dizwitterion

> <DEFINITION>
A zwitterion that is derived from LL-2,6-diaminopimelic acid by deprotonation of both carboxylic acid groups and protonation of both amino groups.

> <STAR>
3

> <SYNONYM>
LL-2,6-diaminopimelic acid dizwitterion; L,L-2,6-diaminopimelic acid dizwitterion; (S,S)-2,6-diaminopimelic acid dizwitterion; (2S,6S)-2,6-diazaniumylheptanedioate; (2S,6S)-2,6-diaminoheptanedioate

> <IUPAC_NAME>
(2S,6S)-2,6-diammonioheptanedioate

> <FORMULA>
C7H14N2O4

> <MASS>
190.19710

> <MONOISOTOPIC_MASS>
190.09536

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1

> <INCHIKEY>
GMKMEZVLHJARHF-WHFBIAKZSA-N

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