Marvin  11140612142D          

 10 10  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4126   -1.2695    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6674   -0.4849    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.4124   -1.2695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4521   -0.2301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3819    0.7527    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3819   -0.0723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0964   -0.4848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6674   -0.4848    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3819   -0.8973    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  9  1  1  0  0  0  0
  9  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  3  5  1  6  0  0  0
  3  4  1  0  0  0  0
  9  7  1  0  0  0  0
  7  6  2  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  6  0  0  0
M  END
> <ID>
CHEBI:6151

> <NAME>
(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic acid

> <STAR>
3

> <SYNONYM>
L-1-Pyrroline-3-hydroxy-5-carboxylate; 3-Hydroxy-L-1-pyrroline-5-carboxylate; (3R,5S)-1-Pyrroline-3-hydroxy-5-carboxylate

> <IUPAC_NAME>
(2S,4R)-4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid

> <FORMULA>
C5H7NO3

> <MASS>
129.11402

> <MONOISOTOPIC_MASS>
129.04259

> <CHARGE>
0

> <SMILES>
[H][C@]1(C[C@@H](O)C=N1)C(O)=O

> <INCHI>
InChI=1S/C5H7NO3/c7-3-1-4(5(8)9)6-2-3/h2-4,7H,1H2,(H,8,9)/t3-,4+/m1/s1

> <INCHIKEY>
WFOFKRKDDKGRIK-DMTCNVIQSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
3947

> <KEGG_COMPOUND_ACCESSION>
C04281

$$$$