Mrv0541 01071511062D          

 10 10  0  0  0  0            999 V2000
    5.4802   -2.0553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2351   -2.7612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0600   -2.7612    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.6468   -4.0307    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9795   -3.5454    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1825   -3.7590    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3146   -3.5460    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.5241   -4.4740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1115   -3.7596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5241   -3.0450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  1  0  0  0
  2  3  1  0  0  0  0
  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  5  4  1  0  0  0  0
  7  4  1  0  0  0  0
  5  6  1  1  0  0  0
  7  9  1  6  0  0  0
  9  8  2  0  0  0  0
  9 10  1  0  0  0  0
M  END
> <ID>
CHEBI:46486

> <NAME>
(3R,5R)-5-amino-3-methyl-D-proline

> <DEFINITION>
An  aminopyrrolidine that is D-proline substituted by a amino group at position 5 and a methyl group at position 3.

> <STAR>
3

> <SYNONYM>
5-AMINO-3-METHYL-PYRROLIDINE-2-CARBOXYLIC ACID; (2R,3R,5R)-5-amino-3-methylpyrrolidine-2-carboxylic acid

> <IUPAC_NAME>
(3R,5R)-5-amino-3-methyl-D-proline

> <FORMULA>
C6H12N2O2

> <MASS>
144.17170

> <MONOISOTOPIC_MASS>
144.08988

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C6H12N2O2/c1-3-2-4(7)8-5(3)6(9)10/h3-5,8H,2,7H2,1H3,(H,9,10)/t3-,4-,5-/m1/s1

> <INCHIKEY>
ZELPFFKOULVLMW-UOWFLXDJSA-N

> <PDBECHEM_ACCESSION>
X7O

$$$$