KEGG   COMPOUND: C02165
Entry
C02165                      Compound                               

Name
Leukotriene B4;
(6Z,8E,10E,14Z)-(5S,12R)-5,12-Dihydroxyeicosa-6,8,10,14-tetraenoate;
(6Z,8E,10E,14Z)-(5S,12R)-5,12-Dihydroxyicosa-6,8,10,14-tetraenoate;
LTB4
Formula
C20H32O4
Exact mass
336.2301
Mol weight
336.4657
Structure
Reaction
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map03320  PPAR signaling pathway
map04080  Neuroactive ligand-receptor interaction
map04726  Serotonergic synapse
map04750  Inflammatory mediator regulation of TRP channels
map04976  Bile secretion
map07034  Eicosanoids
Enzyme
1.14.14.94      3.3.2.6
Brite
Compounds with biological roles [BR:br08001]
 Lipids
  Eicosanoids
   Leukotrienes
    C02165  Leukotriene B4
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0302 Leukotrienes
    C02165  Leukotriene B4
Other DBs
CAS: 71160-24-2
PubChem: 5240
ChEBI: 15647
ChEMBL: CHEMBL65061
LIPIDMAPS: LMFA03020001 LMFA03020004 LMFA03020030
LipidBank: XPR3101
PDB-CCD: LTB[PDBj]
3DMET: B01542
NIKKAJI: J240.041C
LinkDB
KCF data

ATOM        24
            1   C2b C    26.2830  -14.7187
            2   C2b C    24.9723  -14.7247
            3   C1c C    27.4246  -14.0547
            4   C2b C    23.8248  -14.0547
            5   C1b C    28.5721  -14.7071
            6   O1a O    27.4130  -12.7266
            7   C2b C    22.7180  -14.6897
            8   C1b C    29.7082  -14.0373
            9   C2b C    21.6054  -14.0547
            10  C1b C    30.8557  -14.6954
            11  C2b C    20.5045  -14.6838
            12  C6a C    31.9916  -14.0256
            13  C1c C    19.2288  -14.6780
            14  O6a O    33.1448  -14.6780
            15  O6a O    31.9799  -12.7033
            16  C1b C    18.2036  -16.8682
            17  O1a O    19.2171  -13.2857
            18  C2b C    19.2347  -19.0701
            19  C2b C    20.5162  -19.0642
            20  C1b C    21.6113  -18.4177
            21  C1b C    22.7296  -19.0526
            22  C1b C    23.8307  -18.4061
            23  C1b C    24.9549  -19.0352
            24  C1a C    25.8693  -18.2022
BOND        23
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 1 #Up
            6     4   7 2
            7     5   8 1
            8     7   9 1
            9     8  10 1
            10    9  11 2
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   12  15 2
            15   13  16 1
            16   13  17 1 #Up
            17   16  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1

» Japanese version

KEGG   COMPOUND: C14776
Entry
C14776                      Compound                               

Name
8(S)-HETE;
(5Z,9E,11Z,14Z)-(8S)-8-Hydroxyeicosa-5,9,11,14-tetraenoic acid;
(5Z,9E,11Z,14Z)-(8S)-8-Hydroxyicosa-5,9,11,14-tetraenoic acid
Formula
C20H32O3
Exact mass
320.2351
Mol weight
320.4663
Structure
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map03320  PPAR signaling pathway
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
    C14776  8(S)-HETE
Other DBs
CAS: 98462-03-4
PubChem: 17395774
ChEBI: 34486
LIPIDMAPS: LMFA03060006 LMFA03060086
LipidBank: DFA8131
NIKKAJI: J855.517F
LinkDB
KCF data

ATOM        23
            1   C1c C    19.5315  -16.5055
            2   C2b C    20.9282  -17.2055
            3   C1b C    18.3172  -17.2073
            4   C2b C    22.1423  -16.5073
            5   C2b C    17.1101  -16.5055
            6   C2b C    23.3566  -17.2055
            7   C2b C    15.7065  -16.5055
            8   C2b C    24.7533  -17.2055
            9   C1b C    14.5062  -17.2073
            10  C1b C    25.9673  -16.3673
            11  C1b C    13.2850  -16.5055
            12  C2b C    27.1745  -17.1355
            13  C1b C    12.0707  -17.2073
            14  C2b C    28.5783  -17.1355
            15  C6a C    10.8636  -16.5055
            16  C1b C    29.7924  -16.2973
            17  O6a O     9.6495  -17.2073
            18  O6a O    10.8636  -15.1086
            19  C1b C    30.9996  -17.0655
            20  C1b C    32.2139  -16.2973
            21  C1b C    33.4210  -17.0655
            22  C1a C    34.6353  -16.2973
            23  O1a O    19.1724  -15.0264
BOND        22
            1     1   2 1
            2     1   3 1
            3     2   4 2
            4     3   5 1
            5     4   6 1
            6     5   7 2
            7     6   8 2
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   12  14 2
            14   13  15 1
            15   14  16 1
            16   15  17 1
            17   15  18 2
            18   16  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22    1  23 1 #Down

» Japanese version

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