KEGG   COMPOUND: C02198Help
Entry
C02198                      Compound                               

Name
Thromboxane A2;
(5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate;
(5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid;
TXA2
Formula
C20H32O5
Exact mass
352.225
Mol weight
352.4651
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
Eicosanoids
Reaction
Pathway
Arachidonic acid metabolism
Metabolic pathways
Neuroactive ligand-receptor interaction
Serotonergic synapse
Eicosanoids
Enzyme
Brite
Compounds with biological roles [BR:br08001]
 Lipids
  Eicosanoids
   Thromboxane
    C02198  Thromboxane A2
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0303 Thromboxanes
    C02198  Thromboxane A2
BRITE hierarchy
Other DBs
CAS: 
57576-52-0
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C1y C    13.3808  -12.8019
            2   C1y C    14.5810  -13.4905
            3   C1x C    12.1870  -13.4905
            4   O2x O    13.3746  -14.1853
            5   C1y C    14.5810  -14.8801
            6   C1b C    15.7875  -12.7830
            7   C1y C    12.1870  -14.8801
            8   O2x O    13.3808  -15.5812
            9   C2b C    15.7939  -15.5749
            10  C2b C    17.0003  -13.4778
            11  C2b C    17.0066  -14.8548
            12  C2b C    18.3711  -13.5414
            13  C1c C    18.2068  -15.5244
            14  C1b C    19.5902  -12.7513
            15  C1b C    19.3817  -14.8169
            16  O1a O    18.2259  -16.8951
            17  C1b C    20.7904  -13.4335
            18  C1b C    20.5820  -15.4865
            19  C1b C    21.9716  -12.7325
            20  C1b C    21.7631  -14.7790
            21  C6a C    23.1654  -13.4146
            22  C1b C    23.2348  -15.5244
            23  O6a O    24.3530  -12.7134
            24  O6a O    23.1845  -14.7032
            25  C1a C    24.6626  -14.7601
BOND        26
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     5   8 1
            8     5   9 1 #Up
            9     6  10 1
            10    9  11 2
            11   10  12 2
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 1 #Down
            16   14  17 1
            17   15  18 1
            18   17  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22   21  23 1
            23   21  24 2
            24   22  25 1
            25    7   4 1 #Down
            26    7   8 1

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