KEGG   COMPOUND: C05951Help
Entry
C05951                      Compound                               

Name
Leukotriene D4;
LTD4
Formula
C25H40N2O6S
Exact mass
496.2607
Mol weight
496.6599
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Arachidonic acid metabolism
Metabolic pathways
Neuroactive ligand-receptor interaction
Fc epsilon RI signaling pathway
Asthma
Enzyme
2.3.2.2         2.3.2.-         3.4.19.14
Brite
Compounds with biological roles [BR:br08001]
 Lipids
  Eicosanoids
   Leukotrienes
    C05951  Leukotriene D4
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0302 Leukotrienes
    C05951  Leukotriene D4
BRITE hierarchy
Other DBs
CAS: 
73836-78-9
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        34
            1   C1c C    25.8085  -13.7535
            2   S2a S    26.4302  -15.4057
            3   C1c C    26.9369  -13.0973
            4   C2b C    24.6572  -13.0973
            5   C1b C    27.7428  -15.4000
            6   C1b C    28.0825  -13.7535
            7   O1a O    26.9426  -11.7788
            8   C2b C    23.5288  -13.7477
            9   C1c C    28.3934  -16.5456
            10  C1b C    29.2282  -13.1029
            11  C2b C    22.3832  -13.0914
            12  C5a C    29.7060  -16.5399
            13  N1a N    27.7486  -17.6912
            14  C1b C    30.3623  -13.7592
            15  C2b C    21.2376  -13.7477
            16  N1b N    30.3738  -17.6856
            17  O5a O    30.3738  -15.4000
            18  C6a C    31.5022  -13.1029
            19  C2b C    20.0976  -13.0914
            20  C1b C    31.6863  -17.6856
            21  O6a O    32.6478  -13.7592
            22  O6a O    31.5022  -11.7501
            23  C2b C    18.7851  -13.0973
            24  C6a C    32.3426  -18.8312
            25  C1b C    17.6625  -15.3022
            26  O6a O    33.6552  -18.8253
            27  O6a O    31.6922  -19.9594
            28  C2b C    18.7103  -17.5588
            29  C2b C    20.0228  -17.5532
            30  C1b C    21.1569  -16.8854
            31  C1b C    22.3084  -17.5358
            32  C1b C    23.4366  -16.8680
            33  C1b C    24.5938  -17.5243
            34  C1a C    25.5322  -16.6665
BOND        33
            1     1   2 1 #Down
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     3   7 1 #Up
            7     4   8 2
            8     5   9 1
            9     6  10 1
            10    8  11 1
            11    9  12 1
            12    9  13 1 #Up
            13   10  14 1
            14   11  15 2
            15   12  16 1
            16   12  17 2
            17   14  18 1
            18   15  19 1
            19   16  20 1
            20   18  21 1
            21   18  22 2
            22   19  23 2
            23   20  24 1
            24   23  25 1
            25   24  26 1
            26   24  27 2
            27   25  28 1
            28   28  29 2
            29   29  30 1
            30   30  31 1
            31   31  32 1
            32   32  33 1
            33   33  34 1

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