Chemical Properties of Rutin

Rutin

InChI
InChI=1S/C27H30O16.3H2O/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9;;;/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3;3*1H2
InChI Key
NLLBWFFSGHKUSY-UHFFFAOYSA-N
Formula
C27H36O19
SMILES
CC1OC(OCC2OC(Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)C(O)C(O)C2O)C(O)C(O)C1O.O.O.O
Molecular Weight1
664.56
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Physical Properties

Property Value Unit Source
Δfus 82.30 kJ/mol Solubility of Flavonoids in Organic Solvents
Tfus 450.35 K Measurement and correlation of the solubilities of luteolin and rutin in five imidazole-based ionic liquids

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Similar Compounds

Flavone-3-rutinoside, 3,3',4',5,7-pentahydroxy. 3-O,6-O,N-Triacetylnormorphine. 3-propionyl-morphine. Benzylmorphine. acetylepibaptifoline. Brucine. PACLITAXEL. Nicocodine. OXYCOLCHICINE. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. Methyldesorphine. TCN. Ergocristine. DIHYDROERGOTAMINE. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form).

Find more compounds similar to Rutin.

Mixtures

Sources

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