KEGG   COMPOUND: C03461Help
Entry
C03461                      Compound                               

Name
2-trans,6-trans-Farnesal;
trans,trans-Farnesal;
Farnesal;
(2E,6E)-3,7,11-Trimethyl-2,6,10-dodecatrienal;
(2E,6E)-Farnesal
Formula
C15H24O
Exact mass
220.1827
Mol weight
220.3505
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00900  Terpenoid backbone biosynthesis
map00909  Sesquiterpenoid and triterpenoid biosynthesis
map00981  Insect hormone biosynthesis
map01110  Biosynthesis of secondary metabolites
map01130  Biosynthesis of antibiotics
Enzyme
1.1.1.216       1.1.1.354       1.1.3.-         1.2.1.3         
1.8.3.5         1.8.3.6
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010301 Acyclic farnesane sesquiterpenoids
     C03461  2-trans,6-trans-Farnesal
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Farnesenes
    C03461  2-trans,6-trans-Farnesal
BRITE hierarchy
Other DBs
CAS: 502-67-0
PubChem: 6281
ChEBI: 15894
ChEMBL: CHEMBL3120646
LIPIDMAPS: LMPR0103010012
KNApSAcK: C00030246 C00035091
3DMET: B00588
NIKKAJI: J102.721B
KCF data Show

ATOM        16
            1   C2c C    27.1550  -18.5750
            2   C2b C    28.3653  -19.2766
            3   C1b C    25.9447  -19.2766
            4   C1a C    27.1550  -17.1780
            5   C1b C    29.5820  -18.5750
            6   C1b C    24.7281  -18.5750
            7   C1b C    30.7923  -19.2766
            8   C2b C    23.5178  -19.2766
            9   C2c C    32.0026  -18.5750
            10  C2c C    22.3077  -18.5750
            11  C2b C    33.2192  -19.2766
            12  C1a C    32.0026  -17.1780
            13  C1a C    21.0909  -19.2766
            14  C1a C    22.3077  -17.1780
            15  C4a C    34.4295  -18.5750
            16  O4a O    35.6396  -19.2766
BOND        15
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     5   7 1
            7     6   8 1
            8     7   9 1
            9     8  10 2
            10    9  11 2
            11    9  12 1
            12   10  13 1
            13   10  14 1
            14   11  15 1
            15   15  16 2

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