1.0 2010-04-08 22:12:24 UTC 2025-11-19 01:46:39 UTC FDB016375 Quercetin 7-glucosylrhamnoside Isolated from Capparis spinosa (caper) [DFC]. Quercetin 7-glucosylrhamnoside is found in herbs and spices. Quercetin 7-[glucosyl-(1->?)-rhamnoside] Quercetin 7-glucosylrhamnoside Quercetin 7-O-[b-D-glucopyranosyl-(1->?)-a-L-rhamnopyranoside] Quercetin 7-O-[b-D-glucosyl-(1->?)-a-L-rhamnoside] C27H30O16 610.5175 610.153384912 7-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4H-chromen-4-one 7-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-3,5-dihydroxychromen-4-one 79080-63-0 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC2=CC(O)=C3C(=O)C(O)=C(OC3=C2)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C27H30O16/c1-8-17(32)20(35)23(38)26(39-8)43-25-21(36)18(33)15(7-28)42-27(25)40-10-5-13(31)16-14(6-10)41-24(22(37)19(16)34)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-21,23,25-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1 HIEKMCGJSNLAGG-MTKPOXERSA-N belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Flavonoid-7-O-glycosides Organic compounds Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 3-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids Acetals Benzene and substituted derivatives Catechols Chromones Disaccharides Flavonols Heteroaromatic compounds Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols Pyranones and derivatives Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid 3-hydroxyflavone 3-hydroxyflavonoid 4'-hydroxyflavonoid 5-hydroxyflavonoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Catechol Chromone Disaccharide Flavone Flavonoid-7-o-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenolic glycoside Polyol Primary alcohol Pyran Pyranone Secondary alcohol Vinylogous acid logp -0.18 ALOGPS logs -2.26 ALOGPS solubility 3.34e+00 g/l ALOGPS logp -0.84 ChemAxon pka_strongest_acidic 7.98 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 7-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4H-chromen-4-one ChemAxon average_mass 610.5175 ChemAxon mono_mass 610.153384912 ChemAxon smiles C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC2=CC(O)=C3C(=O)C(O)=C(OC3=C2)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H](O)[C@H]1O ChemAxon formula C27H30O16 ChemAxon inchi InChI=1S/C27H30O16/c1-8-17(32)20(35)23(38)26(39-8)43-25-21(36)18(33)15(7-28)42-27(25)40-10-5-13(31)16-14(6-10)41-24(22(37)19(16)34)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-21,23,25-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1 ChemAxon inchikey HIEKMCGJSNLAGG-MTKPOXERSA-N ChemAxon polar_surface_area 265.52 ChemAxon refractivity 139.88 ChemAxon polarizability 58.49 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 16 ChemAxon donor_count 10 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17560 Specdb::CMs 506325 Specdb::CMs 506326 Specdb::CMs 506327 Specdb::CMs 506328 Specdb::CMs 506329 Specdb::CMs 506330 Specdb::CMs 506331 Specdb::CMs 506332 Specdb::CMs 506333 Specdb::CMs 506334 Specdb::CMs 506335 Specdb::CMs 506336 Specdb::CMs 506337 Specdb::CMs 506338 Specdb::CMs 506339 Specdb::CMs 506340 Specdb::CMs 506341 Specdb::CMs 506342 Specdb::CMs 506343 Specdb::CMs 506344 Specdb::CMs 506345 Specdb::CMs 506346 Specdb::CMs 506347 Specdb::CMs 506348 Specdb::MsMs 45378 Specdb::MsMs 45379 Specdb::MsMs 45380 Specdb::MsMs 110895 Specdb::MsMs 110896 Specdb::MsMs 110897 Specdb::MsMs 2426626 Specdb::MsMs 2426627 Specdb::MsMs 2426628 Specdb::MsMs 2511619 Specdb::MsMs 2511620 Specdb::MsMs 2511621 Specdb::NmrOneD 32622 Specdb::NmrOneD 32623 Specdb::NmrOneD 32624 Specdb::NmrOneD 32625 Specdb::NmrOneD 32626 Specdb::NmrOneD 32627 Specdb::NmrOneD 32628 Specdb::NmrOneD 32629 Specdb::NmrOneD 32630 Specdb::NmrOneD 32631 Specdb::NmrOneD 32632 Specdb::NmrOneD 32633 Specdb::NmrOneD 32634 Specdb::NmrOneD 32635 Specdb::NmrOneD 32636 Specdb::NmrOneD 32637 Specdb::NmrOneD 32638 Specdb::NmrOneD 32639 Specdb::NmrOneD 32640 Specdb::NmrOneD 32641 HMDB0039383 Herbs and Spices Unknown generic