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CHEBI:135855 - tocofibrate

ChEBI IDCHEBI:135855
ChEBI Nametocofibrate
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC39H59ClO4
Net Charge0
Average Mass627.350
Monoisotopic Mass626.41019
SMILESCc1c(C)c2c(c(C)c1OC(=O)C(C)(C)Oc1ccc(Cl)cc1)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2
InChIInChI=1S/C39H59ClO4/c1-26(2)14-11-15-27(3)16-12-17-28(4)18-13-24-39(10)25-23-34-31(7)35(29(5)30(6)36(34)44-39)42-37(41)38(8,9)43-33-21-19-32(40)20-22-33/h19-22,26-28H,11-18,23-25H2,1-10H3/t27-,28-,39-/m1/s1
InChIKeyVPRFDABTJNLKKR-XHZSPPMBSA-N
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
ChEBI Ontology
Outgoing Relation(s)
tocofibrate (CHEBI:135855) is a tocol (CHEBI:39437)
Manual XrefsDatabases
2688DrugCentral
Registry NumbersSources
CAS:50465-39-9DrugCentral