Mrv0541 01121516212D          

  7  7  0  0  1  0            999 V2000
   18.5161   -6.6454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1840   -7.1297    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.7704   -5.8605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8510   -6.6442    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   19.5955   -5.8599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6358   -6.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2485   -6.3460    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  5  4  1  0  0  0  0
  4  6  1  6  0  0  0
  6  7  1  0  0  0  0
M  END
> <ID>
CHEBI:84258

> <NAME>
D-prolinol

> <DEFINITION>
The D-enantiomer of prolinol. Metabolite observed in cancer metabolism.

> <STAR>
3

> <IUPAC_NAME>
(2R)-pyrrolidin-2-ylmethanol

> <FORMULA>
C5H11NO

> <MASS>
101.14690

> <MONOISOTOPIC_MASS>
101.08406

> <CHARGE>
0

> <SMILES>
OC[C@H]1CCCN1

> <INCHI>
InChI=1S/C5H11NO/c7-4-5-2-1-3-6-5/h5-7H,1-4H2/t5-/m1/s1

> <INCHIKEY>
HVVNJUAVDAZWCB-RXMQYKEDSA-N

> <CAS_REGISTRY_NUMBER>
68832-13-3

> <REAXYS_REGISTRY_NUMBER>
1523669

> <CHEMIDPLUS>
68832-13-3

> <PUBMED_CITATION>
25518943

$$$$