Marvin  10311110522D          

  9  9  0  0  0  0            999 V2000
   17.0115   -5.3870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3530   -5.8674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6812   -5.8674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.0115   -4.5657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6027   -6.6546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4277   -6.6546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7228   -4.1532    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2924   -4.1571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1146   -7.3206    0.0000 O   0  0  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  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  5  6  1  0  0  0  0
M  END
> <ID>
CHEBI:20392

> <NAME>
4-hydroxyproline

> <DEFINITION>
A monohydroxyproline where the hydroxy group is located at the 4-position. It is found in  fibrillar collagen.

> <STAR>
3

> <SYNONYM>
4Hyp

> <IUPAC_NAME>
4-hydroxyproline

> <FORMULA>
C5H9NO3

> <MASS>
131.12990

> <MONOISOTOPIC_MASS>
131.05824

> <CHARGE>
0

> <SMILES>
OC1CNC(C1)C(O)=O

> <INCHI>
InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)

> <INCHIKEY>
PMMYEEVYMWASQN-UHFFFAOYSA-N

> <WIKIPEDIA_ACCESSION>
Hydroxyproline

> <PUBMED_CITATION>
21988268; 24563386; 24695516; 436278

$$$$