CHEBI:66295 - rediocide F

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name rediocide F
ChEBI ID CHEBI:66295
Definition A diterpenoid of the class of daphnane-type terpenes. It is isolated from Trigonostemon reidioides and has been shown to exhibit insecticidal activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C45H52O13
Net Charge 0
Average Mass 800.88660
Monoisotopic Mass 800.34079
InChI InChI=1S/C45H52O13/c1-24-27-18-19-29(24)30(53-38(48)26-12-6-4-7-13-26)16-10-11-17-33(47)54-32-21-20-31-42(32,51)39(49)41(23-46)36(55-41)34-37-44(52,40(3,50)22-27)35-25(2)43(31,34)58-45(56-35,57-37)28-14-8-5-9-15-28/h4-17,24-25,27,29-32,34-37,39,46,49-52H,18-23H2,1-3H3/b16-10-,17-11+/t24-,25+,27+,29-,30+,31+,32-,34-,35-,36-,37+,39+,40+,41-,42+,43-,44-,45-/m0/s1
InChIKey IXYFWJDPNIHVPG-WLPVKWEMSA-N
SMILES [H][C@@]12CC[C@H](C[C@@](C)(O)[C@]3(O)[C@H]4O[C@]5(O[C@@H]3[C@]3([H])[C@@H]6O[C@]6(CO)[C@@H](O)[C@]6(O)[C@H](CC[C@@]6([H])[C@@]3(O5)[C@@H]4C)OC(=O)\C=C\C=C/[C@H]1OC(=O)c1ccccc1)c1ccccc1)[C@@H]2C
Metabolite of Species Details
Trigonostemon reidioides (IPNI:358060-1) Found in root (BTO:0001188). See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): insecticide
Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing rediocide F (CHEBI:66295) has role insecticide (CHEBI:24852)
rediocide F (CHEBI:66295) has role metabolite (CHEBI:25212)
rediocide F (CHEBI:66295) is a benzoate ester (CHEBI:36054)
rediocide F (CHEBI:66295) is a diterpenoid (CHEBI:23849)
rediocide F (CHEBI:66295) is a epoxide (CHEBI:32955)
rediocide F (CHEBI:66295) is a ortho ester (CHEBI:71989)
rediocide F (CHEBI:66295) is a terpene lactone (CHEBI:37668)
Registry Number Type Source
10143605 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
16204992 PubMed citation Europe PMC
Last Modified
22 April 2013