1-Peroxyferolide

Representations & DB's id
ChEBI:	CHEBI:666
ChEMBL:	CHEMBL518136
PubChem:	442290
IUPAC:	[(1S,2R,4R,7R,10R,11R)-7-hydroperoxy-4-methyl-8,12-dimethylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradecan-10-yl] acetate
Standard InChI:	InChI=1S/C17H22O7/c1-8-7-12(21-10(3)18)13-9(2)16(19)22-14(13)15-17(4,23-15)6-5-11(8)24-20/h11-15,20H,1-2,5-7H2,3-4H3/t11-,12-,13-,14+,15-,17-/m1/s1
Standard InChI Key:	IHYLMNWQQGXGJT-TYVJZBCKSA-N
SMILES:	OO[C@@H]1CC[C@@]2(C)O[C@@H]2[C@@H]2[C@@H]([C@@H](CC1=C)OC(=O)C)C(=C)C(=O)O2

Molecular propeties
AlogP:	1.77
Hydrogen bonds acceptors:	7
Hydrogen bonds donors:	1
Rotatable bonds:	2
Number of rings:	3
Molecular Weight:	338.14
Topological polar surface area:	94.6
Number of aromatic rings:	0
Fsp3:	0.647
Number of carbons:	17

Plant sources

Part of plant	Plant name	Ref.
Plant	Polygala tenuifolia

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.