1.0 2010-04-08 22:14:36 UTC 2025-11-19 02:25:31 UTC FDB019818 Carthamidin 6,7-diglucoside Constituent of the flowers of Carthamus tinctorius (safflower). Carthamidin 6,7-diglucoside is found in fats and oils and herbs and spices. (S)-4',5,6,7-Tetrahydroxyflavanone 6,7-di-O-b-D-glucopyranoside (S)-Carthamidin 6,7-di-O-b-D-glucopyranoside (S)-Carthamidin 6,7-diglucoside C27H32O16 612.5334 612.169034976 5-hydroxy-2-(4-hydroxyphenyl)-6,7-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-3,4-dihydro-2H-1-benzopyran-4-one 5-hydroxy-2-(4-hydroxyphenyl)-6,7-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-2,3-dihydro-1-benzopyran-4-one 7783-06-4 OCC1OC(OC2=C(OC3OC(CO)C(O)C(O)C3O)C(O)=C3C(=O)CC(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O InChI=1S/C27H32O16/c28-7-15-18(32)21(35)23(37)26(41-15)40-14-6-13-17(11(31)5-12(39-13)9-1-3-10(30)4-2-9)20(34)25(14)43-27-24(38)22(36)19(33)16(8-29)42-27/h1-4,6,12,15-16,18-19,21-24,26-30,32-38H,5,7-8H2 YIVXUBJSZSRYMU-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'-hydroxyflavonoids 5-hydroxyflavonoids Acetals Alkyl aryl ethers Aryl alkyl ketones Benzene and substituted derivatives Chromones Flavanones Hexoses Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 4'-hydroxyflavonoid 5-hydroxyflavonoid Acetal Alcohol Alkyl aryl ether Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Flavan Flavanone Flavonoid-7-o-glycoside Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Hydroxyflavonoid Ketone Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenolic glycoside Polyol Primary alcohol Secondary alcohol Vinylogous acid logp -1.12 ALOGPS logs -1.83 ALOGPS solubility 9.13e+00 g/l ALOGPS melting_point Mp 207° dec. logp -2 ChemAxon pka_strongest_acidic 9.41 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 5-hydroxy-2-(4-hydroxyphenyl)-6,7-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 612.5334 ChemAxon mono_mass 612.169034976 ChemAxon smiles OCC1OC(OC2=C(OC3OC(CO)C(O)C(O)C3O)C(O)=C3C(=O)CC(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O ChemAxon formula C27H32O16 ChemAxon inchi InChI=1S/C27H32O16/c28-7-15-18(32)21(35)23(37)26(41-15)40-14-6-13-17(11(31)5-12(39-13)9-1-3-10(30)4-2-9)20(34)25(14)43-27-24(38)22(36)19(33)16(8-29)42-27/h1-4,6,12,15-16,18-19,21-24,26-30,32-38H,5,7-8H2 ChemAxon inchikey YIVXUBJSZSRYMU-UHFFFAOYSA-N ChemAxon polar_surface_area 265.52 ChemAxon refractivity 137.56 ChemAxon polarizability 59.51 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 16 ChemAxon donor_count 10 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 296806 Specdb::MsMs 296807 Specdb::MsMs 296808 Specdb::MsMs 338176 Specdb::MsMs 338177 Specdb::MsMs 338178 Specdb::MsMs 2455971 Specdb::MsMs 2455972 Specdb::MsMs 2455973 Specdb::MsMs 2478928 Specdb::MsMs 2478929 Specdb::MsMs 2478930 Specdb::NmrOneD 38482 Specdb::NmrOneD 38483 Specdb::NmrOneD 38484 Specdb::NmrOneD 38485 Specdb::NmrOneD 38486 Specdb::NmrOneD 38487 Specdb::NmrOneD 38488 Specdb::NmrOneD 38489 Specdb::NmrOneD 38490 Specdb::NmrOneD 38491 Specdb::NmrOneD 38492 Specdb::NmrOneD 38493 Specdb::NmrOneD 38494 Specdb::NmrOneD 38495 Specdb::NmrOneD 38496 Specdb::NmrOneD 38497 Specdb::NmrOneD 38498 Specdb::NmrOneD 38499 Specdb::NmrOneD 38500 Specdb::NmrOneD 38501 Specdb::CMs 13954 Specdb::CMs 523806 Specdb::CMs 523807 Specdb::CMs 523808 Specdb::CMs 523809 Specdb::CMs 523810 Specdb::CMs 523811 Specdb::CMs 523812 Specdb::CMs 523813 Specdb::CMs 523814 Specdb::CMs 523815 Specdb::CMs 523816 Specdb::CMs 523817 Specdb::CMs 523818 Specdb::CMs 523819 Specdb::CMs 523820 Specdb::CMs 523821 Specdb::CMs 523822 Specdb::CMs 523823 Specdb::CMs 523824 Specdb::CMs 523825 Specdb::CMs 523826 Specdb::CMs 523827 Specdb::CMs 523828 Specdb::CMs 523829 HMDB40125 #<Reference:0x00007f093c0111d8> Fats and oils Unknown generic Herbs and Spices Unknown generic