1.0 2010-04-08 22:10:49 UTC 2025-11-19 00:19:18 UTC FDB013628 Acacetin 7-[apiosyl(1->6)-glucoside] Constituent of the seeds of Carthamus tinctorius (safflower). Acacetin 7-[apiosyl(1->6)-glucoside] is found in fats and oils and herbs and spices. 4'-Methoxy-5,7-dihydroxyflavone 5-Hydroxy-2-(4-methoxyphenyl)-7-[(6-O-D-apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-4H-1-benzopyran-4-one 5,7-Dihydroxy-4'-methoxyflavone Acacetin 7-[apiosyl(1->6)-glucoside] Acacetin 7-apiosyl (1->6)-glucopyranoside Apigenin 4'-methyl ether 7-apiosyl (1->6)-glucopyranoside C27H30O14 578.5187 578.163555668 7-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one 7-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-2-(4-methoxyphenyl)chromen-4-one 239106-94-6 COC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C=C2O1 InChI=1S/C27H30O14/c1-36-13-4-2-12(3-5-13)17-8-16(30)20-15(29)6-14(7-18(20)40-17)39-25-23(33)22(32)21(31)19(41-25)9-37-26-24(34)27(35,10-28)11-38-26/h2-8,19,21-26,28-29,31-35H,9-11H2,1H3 FSUVCZVLSOYPAU-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 4'-O-methylated flavonoids 5-hydroxyflavonoids Acetals Alkyl aryl ethers Anisoles Chromones Disaccharides Flavones Heteroaromatic compounds Hydrocarbon derivatives Methoxybenzenes O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Phenoxy compounds Polyols Primary alcohols Pyranones and derivatives Secondary alcohols Tertiary alcohols Tetrahydrofurans Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 4p-methoxyflavonoid-skeleton 5-hydroxyflavonoid Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Disaccharide Ether Flavone Flavonoid-7-o-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Methoxybenzene Monocyclic benzene moiety O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol ether Phenolic glycoside Phenoxy compound Polyol Primary alcohol Pyran Pyranone Secondary alcohol Tertiary alcohol Tetrahydrofuran Vinylogous acid logp 0.11 ALOGPS logs -2.83 ALOGPS solubility 8.47e-01 g/l ALOGPS melting_point Mp 240-244° logp -0.69 ChemAxon pka_strongest_acidic 8.51 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 7-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one ChemAxon average_mass 578.5187 ChemAxon mono_mass 578.163555668 ChemAxon smiles COC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C=C2O1 ChemAxon formula C27H30O14 ChemAxon inchi InChI=1S/C27H30O14/c1-36-13-4-2-12(3-5-13)17-8-16(30)20-15(29)6-14(7-18(20)40-17)39-25-23(33)22(32)21(31)19(41-25)9-37-26-24(34)27(35,10-28)11-38-26/h2-8,19,21-26,28-29,31-35H,9-11H2,1H3 ChemAxon inchikey FSUVCZVLSOYPAU-UHFFFAOYSA-N ChemAxon polar_surface_area 214.06 ChemAxon refractivity 136.21 ChemAxon polarizability 56.58 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 14 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 64992 Specdb::MsMs 64993 Specdb::MsMs 64994 Specdb::MsMs 122295 Specdb::MsMs 122296 Specdb::MsMs 122297 Specdb::MsMs 2471751 Specdb::MsMs 2471752 Specdb::MsMs 2471753 Specdb::MsMs 2494142 Specdb::MsMs 2494143 Specdb::MsMs 2494144 Specdb::CMs 19723 Specdb::CMs 44136 Specdb::CMs 282478 Specdb::CMs 381843 Specdb::CMs 381844 Specdb::CMs 381845 Specdb::CMs 381846 Specdb::CMs 381847 Specdb::CMs 381848 Specdb::CMs 381849 Specdb::CMs 381850 Specdb::CMs 381851 Specdb::CMs 381852 Specdb::CMs 381853 Specdb::CMs 381854 Specdb::CMs 381855 Specdb::CMs 381856 Specdb::CMs 381857 Specdb::CMs 381858 Specdb::CMs 381859 Specdb::CMs 381860 Specdb::CMs 381861 Specdb::CMs 381862 Specdb::CMs 381863 Specdb::CMs 381864 Specdb::NmrOneD 129538 Specdb::NmrOneD 129539 Specdb::NmrOneD 129540 Specdb::NmrOneD 129541 Specdb::NmrOneD 129542 Specdb::NmrOneD 129543 Specdb::NmrOneD 129544 Specdb::NmrOneD 129545 Specdb::NmrOneD 129546 Specdb::NmrOneD 129547 Specdb::NmrOneD 129548 Specdb::NmrOneD 129549 Specdb::NmrOneD 129550 Specdb::NmrOneD 129551 Specdb::NmrOneD 129552 Specdb::NmrOneD 129553 Specdb::NmrOneD 129554 Specdb::NmrOneD 129555 Specdb::NmrOneD 129556 Specdb::NmrOneD 129557 HMDB35023 #<Reference:0x000055ce323b7990> Fats and oils Unknown generic Herbs and Spices Unknown generic