KEGG   COMPOUND: C05954Help
Entry
C05954                      Compound                               

Name
Prostaglandin B2;
PGB2
Formula
C20H30O4
Exact mass
334.2144
Mol weight
334.4498
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map04726  Serotonergic synapse
Brite
Compounds with biological roles [BR:br08001]
 Lipids
  Eicosanoids
   Prostaglandins
    C05954  Prostaglandin B2
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0301 Prostaglandins
    C05954  Prostaglandin B2
BRITE hierarchy
Other DBs
CAS: 13367-85-6
PubChem: 8238
ChEBI: 28099
ChEMBL: CHEMBL1901620
LIPIDMAPS: LMFA03010018
LipidBank: XPR1101
3DMET: B01928
NIKKAJI: J16.062H
KCF data Show

ATOM        24
            1   C2y C    21.8555  -15.0031
            2   C2y C    21.8728  -16.4037
            3   C5x C    20.5481  -14.5187
            4   C1b C    22.9528  -13.8591
            5   C1x C    20.4488  -16.7656
            6   C2b C    23.0052  -17.0808
            7   C1x C    19.6842  -15.6041
            8   O5x O    20.1803  -13.1587
            9   C2b C    24.1609  -14.5361
            10  C2b C    24.2835  -16.3572
            11  C2b C    25.5441  -14.5361
            12  C1c C    25.4099  -17.0691
            13  C1b C    26.7463  -13.8300
            14  C1b C    26.6180  -16.3746
            15  O1a O    25.4040  -18.4699
            16  C1b C    27.9545  -14.5187
            17  C1b C    27.8262  -17.0576
            18  C1b C    29.1569  -13.8183
            19  C1b C    29.0284  -16.3689
            20  C6a C    30.3591  -14.5070
            21  C1b C    30.2308  -17.0516
            22  O6a O    31.5616  -13.8007
            23  O6a O    30.3708  -15.8959
            24  C1a C    31.4331  -16.3629
BOND        24
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            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 1

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