KEGG   COMPOUND: C06427
Entry
C06427                      Compound                               
Name
(9Z,12Z,15Z)-Octadecatrienoic acid;
alpha-Linolenic acid;
9,12,15-Octadecatrienoic acid;
Linolenate;
alpha-Linolenate
Formula
C18H30O2
Exact mass
278.2246
Mol weight
278.43
Structure
Reaction
Pathway
map00592  alpha-Linolenic acid metabolism
map01040  Biosynthesis of unsaturated fatty acids
map01060  Biosynthesis of plant secondary metabolites
map01070  Biosynthesis of plant hormones
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00113  Jasmonic acid biosynthesis
Enzyme
1.13.11.12      1.13.11.61      1.13.11.77      1.13.11.92      
1.14.19.-       3.1.1.4         3.1.1.32        3.1.2.2
Brite
Compounds with biological roles [BR:br08001]
 Lipids
  Fatty acids
   Unsaturated fatty acids
    C06427  alpha-Linolenic acid (18:3;9,12,15)
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0103 Unsaturated fatty acids
    Polyunsaturated fatty acids
     C06427  (9Z,12Z,15Z)-Octadeca-9,12,15-trienoic acid
Other DBs
CAS: 463-40-1
PubChem: 8662
ChEBI: 27432
LIPIDMAPS: LMFA01030152
KNApSAcK: C00007247
PDB-CCD: LNL[PDBj]
NIKKAJI: J5.773H
LinkDB
KCF data

ATOM        20
            1   C1b C    22.9537  -16.1663
            2   C1b C    24.1671  -16.8641
            3   C1b C    21.7467  -16.8705
            4   C2b C    25.3869  -16.1599
            5   C1b C    20.5331  -16.1725
            6   C2b C    26.7826  -16.1599
            7   C1b C    19.3197  -16.8767
            8   C1b C    27.9898  -16.8641
            9   C1b C    18.1001  -16.1725
            10  C2b C    29.2032  -16.1599
            11  C1b C    16.8804  -16.8767
            12  C2b C    30.5990  -16.1599
            13  C6a C    15.6732  -16.1789
            14  C1b C    31.8124  -16.8641
            15  O6a O    14.4598  -16.8830
            16  O6a O    15.6670  -14.7830
            17  C2b C    33.0260  -16.1725
            18  C2b C    34.4217  -16.1725
            19  C1b C    35.6351  -16.8705
            20  C1a C    36.8423  -16.1725
BOND        19
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 2
            6     5   7 1
            7     6   8 1
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11   10  12 2
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 2
            16   14  17 1
            17   17  18 2
            18   18  19 1
            19   19  20 1

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