Structure Database (LMSD)

H HO OH O HO O O O
Common Name
Prostaglandin M
Systematic Name
7R-hydroxy-5,11-dioxotetranorprostane-1,16-dioic acid
Synonyms
  • Prostaglandin M
LM ID
LMFA03010194
Formula
C16H24O7
Exact Mass
Calculate m/z
328.152205
Sum Composition
FA 16:4;O5
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Eicosanoids [FA03]
Prostaglandins [FA0301]

String Representations

InChiKey (Click to copy)
XWBICGCZKGTPCH-MBNYWOFBSA-N
InChi (Click to copy)
InChI=1S/C16H24O7/c17-10(3-1-5-15(20)21)9-14(19)12-7-8-13(18)11(12)4-2-6-16(22)23/h11-12,14,19H,1-9H2,(H,20,21)(H,22,23)/t11-,12+,14-/m1/s1
SMILES (Click to copy)
O[C@H](CC(CCCC(O)=O)=O)[C@@]1([H])CCC([C@@H]1CCCC(O)=O)=O

References

Other Databases

CHEBI ID
186746
PubChem CID
175456

Calculated Physicochemical Properties

Heavy Atoms 23
Rings 1
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 323.97
Topological Polar Surface Area 128.97
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 7
logP 1.70
Molar Refractivity 80.34

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Created at
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Updated at
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