KEGG   COMPOUND: C13858
Entry
C13858                      Compound                               
Name
1-O-Octadecyl-sn-glycerol;
1-O-Octadecylglycerol;
Batyl alcohol;
Glycerol octadecyl ether
Formula
C21H44O3
Exact mass
344.329
Mol weight
344.5723
Structure
Brite
Lipids [BR:br08002]
 GL  Glycerolipids
  GL01 Monoradylglycerols
   GL0102 Monoalkylglycerols
    C13858  1-O-Octadecyl-sn-glycerol
Other DBs
CAS: 544-62-7
PubChem: 854103
ChEBI: 34117 74001
LIPIDMAPS: LMGL01020033
KNApSAcK: C00031623
3DMET: B05654
NIKKAJI: J6.419J
KCF data

ATOM        24
            1   C1b C    24.2316  -16.1362
            2   C1b C    23.0192  -15.4368
            3   C1b C    21.8069  -16.1362
            4   C1b C    20.5945  -15.4368
            5   O2a O    19.3821  -16.1362
            6   C1b C    17.9833  -16.1362
            7   C1c C    17.9833  -17.5351
            8   O1a O    16.5844  -17.5351
            9   C1b C    17.9833  -18.9340
            10  O1a O    16.5844  -18.9340
            11  C1b C    25.4444  -15.4355
            12  C1b C    26.6607  -16.1372
            13  C1b C    27.8711  -15.4379
            14  C1b C    29.0854  -16.1385
            15  C1b C    30.2968  -15.4385
            16  C1b C    31.5105  -16.1388
            17  C1b C    32.7221  -15.4387
            18  C1b C    33.9357  -16.1388
            19  C1b C    35.1474  -15.4387
            20  C1b C    36.3610  -16.1388
            21  C1b C    37.5728  -15.4387
            22  C1b C    38.7863  -16.1389
            23  C1b C    39.9981  -15.4387
            24  C1a C    41.2116  -16.1389
BOND        23
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     7   9 1
            9     9  10 1
            10    1  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1

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