Structure database (LMSD)

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LM IDLMFA03010037
Common Name6k-PGF1α-d4
Systematic Name9S,11R,15S-trihydroxy-6-oxo-13E-prostenoic acid (3,3,4,4-d4)
Synonyms6k-Prostaglandin F1α-d4
Exact Mass
374.2602 (neutral)    Calculate m/z:
FormulaC20H30D4O6
CategoryFatty Acyls [FA]
Main ClassEicosanoids [FA03]
Sub ClassProstaglandins [FA0301]
PubChem CID5283044
KEGG IDC05961
HMDB IDHMDB02886
CHEBI ID28158
CAYMAN ID315210
InChIKeyKFGOFTHODYBSGM-GKZGVFJGSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C20H34O6/c1-2-3-4-7-14(21)10-11-16-17(19(24)13-18(16)23)12-15(22)8-5-6-9-20(25)26/h10-11,14,16-19,21,23-24H,2-9,12-13H2,1H3,(H,25,26)/b11-10+/t14-,16+,17+,18+,19-/m0/s1/i5D2,6D2
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SMILES
[C@H]1(/C=C/[C@@H](O)CCCCC)[C@H](O)C[C@H](O)[C@@H]1CC(=O)CC([2H])([2H])C([2H])([2H])CC(=O)O
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MS StandardView lipid standard
StatusActive (Isotopically labelled standard)
CommentsSynthetic deuterated standard