1.02010-04-08 22:09:18 UTC2019-11-26 03:04:06 UTCFDB0107834-Hydroxyphenylacetonitrile triacetylrhamnosideConstituent of the leaves of the horseradish tree (Moringa oleifera, Moringaceae). 4-Hydroxyphenylacetonitrile triacetylrhamnoside is found in brassicas.4-Hydroxyphenylacetonitrile O-(tri-O-acetyl-a-L-rhamnopyranoside)4-Hydroxyphenylacetonitrile O-(tri-O-acetyl-a-L-rhamnoside)4-Hydroxyphenylacetonitrile O-(tri-O-acetylrhamnoside)4-Hydroxyphenylacetonitrile triacetylrhamnosideC20H23NO8405.3985405.1423667174,5-bis(acetyloxy)-2-[4-(cyanomethyl)phenoxy]-6-methyloxan-3-yl acetate4,5-bis(acetyloxy)-2-[4-(cyanomethyl)phenoxy]-6-methyloxan-3-yl acetate123-07-9CC1OC(OC2=CC=C(CC#N)C=C2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OInChI=1S/C20H23NO8/c1-11-17(26-12(2)22)18(27-13(3)23)19(28-14(4)24)20(25-11)29-16-7-5-15(6-8-16)9-10-21/h5-8,11,17-20H,9H2,1-4H3CRZLVGUYFBECND-UHFFFAOYSA-N belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose.Phenolic glycosidesOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbohydrates and carbohydrate conjugatesAromatic heteromonocyclic compoundsAcetalsBenzyl cyanidesCarbonyl compoundsCarboxylic acid estersHexosesHydrocarbon derivativesNitrilesO-glycosyl compoundsOrganic oxidesOrganopnictogen compoundsOxacyclic compoundsOxanesPhenol ethersPhenoxy compoundsTricarboxylic acids and derivativesAcetalAromatic heteromonocyclic compoundBenzenoidBenzyl-cyanideCarbonitrileCarbonyl groupCarboxylic acid derivativeCarboxylic acid esterHexose monosaccharideHydrocarbon derivativeMonocyclic benzene moietyMonosaccharideNitrileO-glycosyl compoundOrganic nitrogen compoundOrganic oxideOrganoheterocyclic compoundOrganonitrogen compoundOrganopnictogen compoundOxacycleOxanePhenol etherPhenolic glycosidePhenoxy compoundTricarboxylic acid or derivativeslogp2.54logs-3.72solubility7.69e-02 g/lmelting_pointMp 103° (synthetic)logp1.47pka_strongest_acidic14.18pka_strongest_basic-4.3iupac4,5-bis(acetyloxy)-2-[4-(cyanomethyl)phenoxy]-6-methyloxan-3-yl acetateaverage_mass405.3985mono_mass405.142366717smilesCC1OC(OC2=CC=C(CC#N)C=C2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OformulaC20H23NO8inchiInChI=1S/C20H23NO8/c1-11-17(26-12(2)22)18(27-13(3)23)19(28-14(4)24)20(25-11)29-16-7-5-15(6-8-16)9-10-21/h5-8,11,17-20H,9H2,1-4H3inchikeyCRZLVGUYFBECND-UHFFFAOYSA-Npolar_surface_area121.15refractivity96.38polarizability40.29rotatable_bond_count9acceptor_count6donor_count0physiological_charge0formal_charge0Specdb::CMs22205Specdb::MsMs161508Specdb::MsMs161509Specdb::MsMs161510Specdb::MsMs96906Specdb::MsMs96907Specdb::MsMs96908HMDB32809#<Reference:0x00005556760bbd10>BrassicasUnknowngeneric3705phenolspice