Structure Database (LMSD)

D D D D D D O OH O OH HO O O
Common Name
Tetranor-PGEM-d6
Systematic Name
11R-hydroxy-9,15-dioxo-2,3,4,5-tetranor-prostan-1,20-dioic acid-d6
Synonyms
  • Tetranor-Prostaglandin EM-d6
LM ID
LMFA03010175
Formula
C16H16D6O7
Exact Mass
Calculate m/z
332.174217
Status
Active (Isotopically labelled standard)
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)
HEYYAAQQDGNHBU-HJQKXVDBSA-N
InChi (Click to copy)
InChI=1S/C16H22O7/c17-10(3-1-2-4-15(20)21)5-6-11-12(7-8-16(22)23)14(19)9-13(11)18/h5-6,11-13,18H,1-4,7-9H2,(H,20,21)(H,22,23)/b6-5+/t11-,12-,13-/m1/s1/i1D2,2D2,4D2
SMILES (Click to copy)
[C@H]1(/C=C/C(=O)CC([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O)[C@H](O)CC(=O)[C@@H]1CCC(=O)O

References

Comments
Synthetic deuterated standard

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
synthetic construct (#32630)
Synthetic deuterated standard

Other Databases

PubChem CID
16061107

Admin

Created at
-
Updated at
29th Jan 2021