KEGG   COMPOUND: C08317
Entry
C08317                      Compound                               
Name
12-Hydroxydodecanoic acid;
omega-Hydroxydodecanoic acid
Formula
C12H24O3
Exact mass
216.1725
Mol weight
216.3172
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0105 Hydroxy fatty acids
    C08317  12-Hydroxydodecanoic acid
Other DBs
CAS: 505-95-3
PubChem: 10515
ChEBI: 39567
LIPIDMAPS: LMFA01050039
KNApSAcK: C00001219
PDB-CCD: 12H[PDBj]
3DMET: B02161
NIKKAJI: J182.260H
LinkDB
KCF data

ATOM        15
            1   C1b C    23.6648  -18.7359
            2   C1b C    24.8759  -18.0372
            3   C1b C    22.4537  -18.0372
            4   C1b C    26.0928  -18.7359
            5   C1b C    21.2367  -18.7359
            6   C1b C    27.2981  -18.0372
            7   C6a C    20.0257  -18.0372
            8   C1b C    28.5091  -18.7359
            9   O6a O    18.8088  -18.7359
            10  O6a O    20.0257  -16.6338
            11  C1b C    29.7260  -18.0372
            12  C1b C    30.9372  -18.7359
            13  C1b C    32.1541  -18.0372
            14  C1b C    33.3652  -18.7359
            15  O1a O    34.5762  -18.0372
BOND        14
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1
            7     6   8 1
            8     7   9 1
            9     7  10 2
            10    8  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1

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