Marvin  07070612142D          

 15 14  0  0  0  0            999 V2000
    3.3172    0.1473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6027   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3172    0.9723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1738   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4593    0.1473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2552   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9696    0.1473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6841   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3986    0.1473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1131   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0317   -0.2652    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8275    0.1473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5420   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8882    0.1473    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8882    0.9723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  2 14  1  0  0  0  0
 14  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  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
  1 11  1  0  0  0  0
 12 10  1  0  0  0  0
 13 12  1  0  0  0  0
 14 15  1  6  0  0  0
M  END
> <ID>
CHEBI:36210

> <NAME>
(S)-3-hydroxylauric acid

> <DEFINITION>
The (S)-enantiomer of 3-hydroxylauric acid.

> <STAR>
3

> <SYNONYM>
(S)-beta-OH lauric acid; (S)-beta-OH dodecanoic acid; (S)-beta-hydroxylauric acid; (S)-beta-hydroxydodecanoic acid; (S)-3-OH lauric acid; (S)-3-OH dodecanoic acid; (S)-3-hydroxydodecanoic acid

> <IUPAC_NAME>
(3S)-3-hydroxydodecanoic acid

> <FORMULA>
C12H24O3

> <MASS>
216.31716

> <MONOISOTOPIC_MASS>
216.17254

> <CHARGE>
0

> <SMILES>
CCCCCCCCC[C@H](O)CC(O)=O

> <INCHI>
InChI=1S/C12H24O3/c1-2-3-4-5-6-7-8-9-11(13)10-12(14)15/h11,13H,2-10H2,1H3,(H,14,15)/t11-/m0/s1

> <INCHIKEY>
MUCMKTPAZLSKTL-NSHDSACASA-N

> <BEILSTEIN_REGISTRY_NUMBER>
5802385

> <LIPID_MAPS_INSTANCE_ACCESSION>
LMFA01050252

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