Structure Database (LMSD)
Common Name
5S-HETE-d8
Systematic Name
5S-hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid (5,6,8,9,11,12,14,15-d8)
Synonyms
LM ID
LMFA03060005
Formula
Exact Mass
Calculate m/z
328.285361
Status
Active (Isotopically labelled standard)
3D model of 5S-HETE-d8
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
KGIJOOYOSFUGPC-IWMWOOIASA-N
InChi (Click to copy)
InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-10,12-14,16,19,21H,2-5,8,11,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,16-14+/t19-/m1/s1/i6D,7D,9D,10D,12D,13D,16D,19D
SMILES (Click to copy)
C(O)(=O)CCC[C@]([2H])(O)/C(/[2H])=C/C(/[2H])=C(/[2H])\C/C(/[2H])=C(/[2H])\C/C(/[2H])=C(/[2H])\CCCCC
References
Comments
Synthetic deuterated standard
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
synthetic construct
(#32630)
Synthetic deuterated standard
Other Databases
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Created at
-
Updated at
29th Jan 2021