1.0 2010-04-08 22:12:28 UTC 2025-11-19 01:47:33 UTC FDB016506 Orientin 7-rhamnoside Isolated from Linum usitatissimum. Orientin 7-rhamnoside is found in tea, flaxseed, and coffee and coffee products. Orientin 7-O-a-L-rhamnopyranoside Orientin 7-O-a-L-rhamnoside Orientin 7-O-rhamnoside Orientin 7-rhamnoside C27H30O15 594.5181 594.15847029 2-(3,4-dihydroxyphenyl)-5-hydroxy-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-5-hydroxy-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]chromen-4-one 29432-29-9 CC1OC(OC2=C(C3OC(CO)C(O)C(O)C3O)C3=C(C(O)=C2)C(=O)C=C(O3)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O InChI=1S/C27H30O15/c1-8-19(33)21(35)24(38)27(39-8)42-15-6-13(32)17-12(31)5-14(9-2-3-10(29)11(30)4-9)40-25(17)18(15)26-23(37)22(36)20(34)16(7-28)41-26/h2-6,8,16,19-24,26-30,32-38H,7H2,1H3 WNHQLQDLHBPVNM-UHFFFAOYSA-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 4'-hydroxyflavonoids 5-hydroxyflavonoids Acetals Benzene and substituted derivatives C-glycosyl compounds Catechols Chromones Dialkyl ethers Flavones Flavonoid 8-C-glycosides Heteroaromatic compounds Hydrocarbon derivatives Monosaccharides 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 4'-hydroxyflavonoid 5-hydroxyflavonoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran C-glycosyl compound Catechol Chromone Dialkyl ether Ether Flavone Flavonoid c-glycoside Flavonoid-7-o-glycoside Flavonoid-8-c-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety Monosaccharide 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 -0.47 ALOGPS logs -2.13 ALOGPS solubility 4.37e+00 g/l ALOGPS logp -1.6 ChemAxon pka_strongest_acidic 8.26 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 2-(3,4-dihydroxyphenyl)-5-hydroxy-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4H-chromen-4-one ChemAxon average_mass 594.5181 ChemAxon mono_mass 594.15847029 ChemAxon smiles CC1OC(OC2=C(C3OC(CO)C(O)C(O)C3O)C3=C(C(O)=C2)C(=O)C=C(O3)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O ChemAxon formula C27H30O15 ChemAxon inchi InChI=1S/C27H30O15/c1-8-19(33)21(35)24(38)27(39-8)42-15-6-13(32)17-12(31)5-14(9-2-3-10(29)11(30)4-9)40-25(17)18(15)26-23(37)22(36)20(34)16(7-28)41-26/h2-6,8,16,19-24,26-30,32-38H,7H2,1H3 ChemAxon inchikey WNHQLQDLHBPVNM-UHFFFAOYSA-N ChemAxon polar_surface_area 256.29 ChemAxon refractivity 138.61 ChemAxon polarizability 56.35 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 15 ChemAxon donor_count 10 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 84672 Specdb::MsMs 84673 Specdb::MsMs 84674 Specdb::MsMs 146571 Specdb::MsMs 146572 Specdb::MsMs 146573 Specdb::MsMs 2678096 Specdb::MsMs 2678097 Specdb::MsMs 2678098 Specdb::MsMs 3031298 Specdb::MsMs 3031299 Specdb::MsMs 3031300 Specdb::NmrOneD 140990 Specdb::NmrOneD 140991 Specdb::NmrOneD 140992 Specdb::NmrOneD 140993 Specdb::NmrOneD 140994 Specdb::NmrOneD 140995 Specdb::NmrOneD 140996 Specdb::NmrOneD 140997 Specdb::NmrOneD 140998 Specdb::NmrOneD 140999 Specdb::NmrOneD 141000 Specdb::NmrOneD 141001 Specdb::NmrOneD 141002 Specdb::NmrOneD 141003 Specdb::NmrOneD 141004 Specdb::NmrOneD 141005 Specdb::NmrOneD 141006 Specdb::NmrOneD 141007 Specdb::NmrOneD 141008 Specdb::NmrOneD 141009 Specdb::CMs 20126 Specdb::CMs 45392 Specdb::CMs 282974 Specdb::CMs 434143 Specdb::CMs 434144 Specdb::CMs 434145 Specdb::CMs 434146 Specdb::CMs 434147 Specdb::CMs 434148 Specdb::CMs 434149 Specdb::CMs 434150 Specdb::CMs 434151 Specdb::CMs 434152 Specdb::CMs 434153 Specdb::CMs 434154 Specdb::CMs 434155 Specdb::CMs 434156 Specdb::CMs 434157 Specdb::CMs 434158 Specdb::CMs 434159 Specdb::CMs 434160 Specdb::CMs 434161 Specdb::CMs 434162 Specdb::CMs 434163 Specdb::CMs 434164 HMDB37447 #<Reference:0x000055ce320466d0> Arabica coffee Type 1 specific Coffea arabica 13443 Black tea Type 1 Coffee and coffee products Unknown generic Flaxseed Type 1 specific Linum usitatissimum 4006 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Robusta coffee Type 1 specific Coffea canephora 49390 Tea Type 1 specific Camellia sinensis 4442