1.0 2010-04-08 22:05:31 UTC 2020-02-24 19:10:37 UTC FDB002777 Cichoriin Isolated from chicory (Cichorium intybus). Cichoriin is found in chicory and green vegetables. 6-Hydroxyskimmin Cichoriin Cichorioside C15H16O9 340.2821 340.07943211 6-hydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one 6-hydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-2-one 531-58-8 OCC1OC(OC2=C(O)C=C3C=CC(=O)OC3=C2)C(O)C(O)C1O InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-4-8-6(3-7(9)17)1-2-11(18)22-8/h1-4,10,12-17,19-21H,5H2 WNBCMONIPIJTSB-UHFFFAOYSA-N belongs to the class of organic compounds known as coumarin glycosides. These are aromatic compounds containing a carbohydrate moiety glycosidically bound to a coumarin moiety. Coumarin glycosides Organic compounds Phenylpropanoids and polyketides Coumarins and derivatives Coumarin glycosides Aromatic heteropolycyclic compounds 1-benzopyrans 1-hydroxy-2-unsubstituted benzenoids Acetals Heteroaromatic compounds Hexoses Hydrocarbon derivatives Hydroxycoumarins Lactones O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols Pyranones and derivatives Secondary alcohols 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Coumarin o-glycoside Coumarin-7-o-glycoside Glycosyl compound Heteroaromatic compound Hexose monosaccharide Hydrocarbon derivative Hydroxycoumarin Lactone Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenolic glycoside Polyol Primary alcohol Pyran Pyranone Secondary alcohol logp -0.54 ALOGPS logs -1.50 ALOGPS solubility 1.08e+01 g/l ALOGPS melting_point Mp 213-214° logp -1.1 ChemAxon pka_strongest_acidic 9.69 ChemAxon pka_strongest_basic -3 ChemAxon iupac 6-hydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one ChemAxon average_mass 340.2821 ChemAxon mono_mass 340.07943211 ChemAxon smiles OCC1OC(OC2=C(O)C=C3C=CC(=O)OC3=C2)C(O)C(O)C1O ChemAxon formula C15H16O9 ChemAxon inchi InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-4-8-6(3-7(9)17)1-2-11(18)22-8/h1-4,10,12-17,19-21H,5H2 ChemAxon inchikey WNBCMONIPIJTSB-UHFFFAOYSA-N ChemAxon polar_surface_area 145.91 ChemAxon refractivity 77.65 ChemAxon polarizability 31.62 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 8 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 12668 Specdb::MsMs 12669 Specdb::MsMs 12670 Specdb::MsMs 19340 Specdb::MsMs 19341 Specdb::MsMs 19342 Specdb::MsMs 2313479 Specdb::MsMs 2313480 Specdb::MsMs 2313481 Specdb::MsMs 2652227 Specdb::MsMs 2652228 Specdb::MsMs 2652229 Specdb::CMs 12562 Specdb::CMs 42189 Specdb::CMs 137866 Specdb::CMs 145600 Specdb::NmrOneD 162269 Specdb::NmrOneD 162270 Specdb::NmrOneD 162271 Specdb::NmrOneD 162272 Specdb::NmrOneD 162273 Specdb::NmrOneD 162274 Specdb::NmrOneD 162275 Specdb::NmrOneD 162276 Specdb::NmrOneD 162277 Specdb::NmrOneD 162278 Specdb::NmrOneD 162279 Specdb::NmrOneD 162280 Specdb::NmrOneD 162281 Specdb::NmrOneD 162282 Specdb::NmrOneD 162283 Specdb::NmrOneD 162284 Specdb::NmrOneD 162285 Specdb::NmrOneD 162286 Specdb::NmrOneD 162287 Specdb::NmrOneD 162288 HMDB30821 #<Reference:0x000055ce2ea45ce8> Chicory Type 1 specific Cichorium intybus 13427 150.0 150.0 150.0 mg/100 g Green vegetables Unknown generic Anti feedant 275 Anti-aggregant 94 Insectifuge 1041 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.