KEGG   COMPOUND: C08367Help
Entry
C08367                      Compound                               

Name
(11E)-Octadecenoic acid;
Vaccenic acid;
trans-11-Octadecenoic acid
Formula
C18H34O2
Exact mass
282.2559
Mol weight
282.4614
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0103 Unsaturated fatty acids
    Monounsaturated fatty acids
     C08367  (E)-Octadec-11-enoic acid
Phytochemical compounds [BR:br08003]
 Fatty acids related compounds
  Fatty acids
   Unsaturated fatty acids
    C08367  Vaccenic acid
BRITE hierarchy
Other DBs
CAS: 693-72-1
PubChem: 10563
ChEBI: 28727
LIPIDMAPS: LMFA01030076 LMFA01030077
LipidBank: DFA0115
KNApSAcK: C00001240
3DMET: B02175
NIKKAJI: J6.936A
LinkDB All DBs
KCF data Show

ATOM        20
            1   C1b C    24.2269  -18.0461
            2   C1b C    25.4270  -18.7502
            3   C1b C    23.0207  -18.7502
            4   C1b C    26.6392  -18.0461
            5   C1b C    21.8084  -18.0461
            6   C1b C    27.8453  -18.7502
            7   C1b C    20.6084  -18.7502
            8   C2b C    29.0577  -18.0461
            9   C1b C    19.3961  -18.0461
            10  C2b C    30.3251  -18.7809
            11  C1b C    18.1899  -18.7502
            12  C1b C    31.5373  -18.0829
            13  C6a C    16.9776  -18.0461
            14  C1b C    32.7436  -18.7809
            15  O6a O    15.7714  -18.7502
            16  O6a O    16.9776  -16.6562
            17  C1b C    33.9497  -18.0829
            18  C1b C    35.1619  -18.7809
            19  C1b C    36.3681  -18.0829
            20  C1a C    37.5682  -18.7809
BOND        19
            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     8  10 2
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 2
            16   14  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1

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