KEGG   COMPOUND: C05953Help
Entry
C05953                      Compound                               

Name
Prostaglandin A2;
PGA2;
Medullin
Formula
C20H30O4
Exact mass
334.2144
Mol weight
334.4498
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map04726  Serotonergic synapse
Brite
Compounds with biological roles [BR:br08001]
 Lipids
  Eicosanoids
   Prostaglandins
    C05953  Prostaglandin A2
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0301 Prostaglandins
    C05953  Prostaglandin A2
BRITE hierarchy
Other DBs
PubChem: 8237
ChEBI: 27820
ChEMBL: CHEMBL1084643
LIPIDMAPS: LMFA03010035 LMFA03010100
LipidBank: XPR1001
PDB-CCD: 8SU[PDBj]
3DMET: B01927
NIKKAJI: J15.713I
KCF data Show

ATOM        24
            1   C1y C    21.7541  -14.9952
            2   C1y C    21.7720  -16.3920
            3   C5x C    20.5199  -14.5142
            4   C1b C    23.0239  -13.8592
            5   C2x C    20.4273  -16.7571
            6   C2b C    22.9775  -17.0701
            7   C2x C    19.6563  -15.5980
            8   O5x O    20.1549  -13.1520
            9   C2b C    24.2294  -14.5547
            10  C2b C    24.1773  -16.3747
            11  C2b C    25.6147  -14.5488
            12  C1c C    25.3827  -17.0527
            13  C1b C    26.8145  -13.8476
            14  C1b C    26.5768  -16.3631
            15  O1a O    25.3770  -18.4554
            16  C1b C    28.0200  -14.5372
            17  C1b C    27.7766  -17.0470
            18  C1b C    29.2140  -13.8360
            19  C1b C    28.9821  -16.3572
            20  C6a C    30.4195  -14.5199
            21  C1b C    30.1877  -17.0411
            22  O6a O    31.6134  -13.8187
            23  O6a O    30.4252  -15.9051
            24  C1a C    31.3932  -16.3456
BOND        24
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     6  10 2
            10    9  11 2
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   12  15 1 #Down
            15   13  16 1
            16   14  17 1
            17   16  18 1
            18   17  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22   20  23 2
            23   21  24 1
            24    5   7 2

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