CHEBI:760679 - flupyropen

ChEBI IDCHEBI:760679
ChEBI Nameflupyropen
Stars
DefinitionAn organic heterotetracyclic compound that is 1,3,4,4a,5,6,6a,12,12a,12b-decahydro-2H,11H-benzo[f]pyrano[4,3-b]chromen-11-one which is substituted by methyl groups at positions 4, 6a, and 12b; hydroxy groups at positions 6, and 12; and a cyclopropylcarbonyloxy group and a cyclopropycarbonyloxymethyl group at positions 3 and 4 respectively, and a 5-fluoropyridin-3-yl group at position 9 (the (3S,4R,4aR,6S,6aS,12R,12aS,12bS stereoisomer). It is an insecticide from Qingdao KingAgroot Chemical Compound Co., Ltd.
Last Modified31 July 2026
SubmitterAdnan
DownloadsMolfile
FormulaC33H38FNO9
Net Charge0
Average Mass611.663
Monoisotopic Mass611.25306
SMILES[H][C@@]12C[C@H](O)[C@@]3(C)Oc4cc(-c5cncc(F)c5)oc(=O)c4[C@H](O)[C@]3([H])[C@@]1(C)CC[C@H](OC(=O)C1CC1)[C@@]2(C)COC(=O)C1CC1
InChIInChI=1S/C33H38FNO9/c1-31-9-8-24(43-29(39)17-6-7-17)32(2,15-41-28(38)16-4-5-16)22(31)12-23(36)33(3)27(31)26(37)25-21(44-33)11-20(42-30(25)40)18-10-19(34)14-35-13-18/h10-11,13-14,16-17,22-24,26-27,36-37H,4-9,12,15H2,1-3H3/t22-,23+,24+,26+,27-,31+,32+,33-/m1/s1
InChIKeyPBHDEJNKJGMQKZ-HRSIRGMGSA-N
Roles Classification
Application:
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.
ChEBI Ontology
Outgoing Relation(s)
flupyropen (CHEBI:760679) has role insecticide (CHEBI:24852)
flupyropen (CHEBI:760679) is a cyclopropanecarboxylate ester (CHEBI:50351)
flupyropen (CHEBI:760679) is a organic heterotetracyclic compound (CHEBI:38163)
flupyropen (CHEBI:760679) is a organofluorine compound (CHEBI:37143)
flupyropen (CHEBI:760679) is a pyridines (CHEBI:26421)
flupyropen (CHEBI:760679) is a secondary alcohol (CHEBI:35681)
flupyropen (CHEBI:760679) is a unclassifieds (CHEBI:27189)
IUPAC Name 
[(3S,4R,4aR,6S,6aS,12R,12aS,12bS)-3-[(cyclopropanecarbonyl)oxy]-9-(5-fluoropyridin-3-yl)-6,12-dihydroxy-4,6a,12b-trimethyl-11-oxo-1,3,4,4a,5,6,6a,12,12a,12b-decahydro-2H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-4-yl]methyl cyclopropanecarboxylate
Synonyms  Source
{(3S,4R,4aR,6S,6aS,12R,12aS,12bS)-3-[(cyclopropanecarbonyl)oxy]-9-(5-fluoropyridin-3-yl)-6,12-dihydroxy-4,6a,12b-trimethyl-11-oxo-1,3,4,4a,5,6,6a,12,12a,12b-decahydro-2H,11H-benzo[f]pyrano[4,3-b][1]benzopyran-4-yl}methyl cyclopropanecarboxylateAlan Wood's Pesticides
[(3S,4R,4aR,6S,6aS,12R,12aS,12bS)-3-[(cyclopropylcarbonyl)oxy]-9-(5-fluoro-3-pyridinyl)-1,3,4,4a,5,6,6a,12,12a,12b-decahydro-6,12-dihydroxy-4,6a,12b-trimethyl-11-oxo-2H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-4-yl]methyl cyclopropanecarboxylateAlan Wood's Pesticides
{(3S,4R,4aR,6S,6aS,12R,12aS,12bS)-3-[(cyclopropylcarbonyl)oxy]-9-(5-fluoro-3-pyridyl)-6,12-dihydroxy-4,6a,12b-trimethyl-11-oxo-1,3,4,4a,5,6,6a,12,12a,12b-decahydro-2H,11H-benzo[f]pyrano[4,3-b]chromen-4-yl}methyl cyclopropanecarboxylateAlan Wood's Pesticides
Manual XrefsDatabases
flupyropenAlan Wood's Pesticides
Registry NumbersSources
CAS:3078478-16-4Alan Wood's Pesticides