1.0 2010-04-08 22:12:29 UTC 2025-11-19 01:47:36 UTC FDB016515 Chrysoeriol 7-[apiofuranosyl-(1->2)-glucoside] Isolated from Apium graveolens (celery seeds) and Petroselinum hortense (parsley). Chrysoeriol 7-[apiofuranosyl-(1->2)-glucoside] is found in many foods, some of which are herbs and spices, green vegetables, celery leaves, and wild celery. 4',5,7-Trihydroxy-3'-methoxyflavone 7-O-[b-D-apiofuranosyl-(1->2)-b-D-glucopyranoside] Chrysoeriol 7-[apiofuranosyl-(1->2)-glucoside] Chrysoeriol 7-O-[b-D-apiofuranosyl-(1->2)-b-D-glucopyranoside] Graveobioside B Luteolin 3'-methyl ether 7-apiosyl-(1->2)-glucoside C27H30O15 594.5181 594.15847029 7-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one 7-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one 33579-63-4 COC1=C(O)C=CC(=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C=C2O1 InChI=1S/C27H30O15/c1-37-17-4-11(2-3-13(17)30)16-7-15(32)20-14(31)5-12(6-18(20)40-16)39-25-23(22(34)21(33)19(8-28)41-25)42-26-24(35)27(36,9-29)10-38-26/h2-7,19,21-26,28-31,33-36H,8-10H2,1H3 GYQQQCVFOLKXGH-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'-O-methylated flavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids Acetals Alkyl aryl ethers Anisoles Chromones Disaccharides Flavones Heteroaromatic compounds Hydrocarbon derivatives Methoxybenzenes Methoxyphenols O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Phenoxy compounds Primary alcohols Pyranones and derivatives Secondary alcohols Tertiary alcohols Tetrahydrofurans Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3p-methoxyflavonoid-skeleton 4'-hydroxyflavonoid 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 Methoxyphenol Monocyclic benzene moiety O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenol ether Phenolic glycoside Phenoxy compound Primary alcohol Pyran Pyranone Secondary alcohol Tertiary alcohol Tetrahydrofuran Vinylogous acid logp 0.02 ALOGPS logs -2.68 ALOGPS solubility 1.23e+00 g/l ALOGPS melting_point Mp 214-216° logp -1 ChemAxon pka_strongest_acidic 8.43 ChemAxon pka_strongest_basic -3 ChemAxon iupac 7-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one ChemAxon average_mass 594.5181 ChemAxon mono_mass 594.15847029 ChemAxon smiles COC1=C(O)C=CC(=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C=C2O1 ChemAxon formula C27H30O15 ChemAxon inchi InChI=1S/C27H30O15/c1-37-17-4-11(2-3-13(17)30)16-7-15(32)20-14(31)5-12(6-18(20)40-16)39-25-23(22(34)21(33)19(8-28)41-25)42-26-24(35)27(36,9-29)10-38-26/h2-7,19,21-26,28-31,33-36H,8-10H2,1H3 ChemAxon inchikey GYQQQCVFOLKXGH-UHFFFAOYSA-N ChemAxon polar_surface_area 234.29 ChemAxon refractivity 138.19 ChemAxon polarizability 58.41 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 15 ChemAxon donor_count 8 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 56949 Specdb::MsMs 56950 Specdb::MsMs 56951 Specdb::MsMs 112485 Specdb::MsMs 112486 Specdb::MsMs 112487 Specdb::MsMs 2745206 Specdb::MsMs 2745207 Specdb::MsMs 2745208 Specdb::MsMs 2937559 Specdb::MsMs 2937560 Specdb::MsMs 2937561 Specdb::NmrOneD 141090 Specdb::NmrOneD 141091 Specdb::NmrOneD 141092 Specdb::NmrOneD 141093 Specdb::NmrOneD 141094 Specdb::NmrOneD 141095 Specdb::NmrOneD 141096 Specdb::NmrOneD 141097 Specdb::NmrOneD 141098 Specdb::NmrOneD 141099 Specdb::NmrOneD 141100 Specdb::NmrOneD 141101 Specdb::NmrOneD 141102 Specdb::NmrOneD 141103 Specdb::NmrOneD 141104 Specdb::NmrOneD 141105 Specdb::NmrOneD 141106 Specdb::NmrOneD 141107 Specdb::NmrOneD 141108 Specdb::NmrOneD 141109 Specdb::CMs 19002 Specdb::CMs 45399 Specdb::CMs 282975 Specdb::CMs 434582 Specdb::CMs 434583 Specdb::CMs 434584 Specdb::CMs 434585 Specdb::CMs 434586 Specdb::CMs 434587 Specdb::CMs 434588 Specdb::CMs 434589 Specdb::CMs 434590 Specdb::CMs 434591 Specdb::CMs 434592 Specdb::CMs 434593 Specdb::CMs 434594 Specdb::CMs 434595 Specdb::CMs 434596 Specdb::CMs 434597 Specdb::CMs 434598 Specdb::CMs 434599 Specdb::CMs 434600 Specdb::CMs 434601 Specdb::CMs 434602 Specdb::CMs 434603 HMDB37454 #<Reference:0x000055ce318aac28> Celery leaves Type 1 specific Apium graveolens var. secalinum 941588 7.92 7.920000076 7.920000076 mg/100 g Green vegetables Unknown generic Herbs and Spices Unknown generic Wild celery Type 1 specific Apium graveolens 4045 467.0 467.0 467.0 mg/100 g