1.02010-04-08 22:09:56 UTC2019-11-26 03:05:56 UTCFDB012004Ethyl gallateOccurs, inter alia, in Indian gooseberry (Phyllanthus emblica). Ethyl gallate is found in many foods, some of which are grape wine, fruits, guava, and vinegar.3,4,5-Trihydroxybenzoic acid ethyl esterEthyl 3,4,5-trihydroxybenzoateEthyl gallateEthylgallateGallic acid ethyl esterNIPA 48Nipagallin aPhyllemblinProgallin AC9H10O5198.174198.052823422ethyl 3,4,5-trihydroxybenzoateethyl gallate831-61-8CCOC(=O)C1=CC(O)=C(O)C(O)=C1InChI=1S/C9H10O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,10-12H,2H2,1H3VFPFQHQNJCMNBZ-UHFFFAOYSA-N belongs to the class of organic compounds known as galloyl esters. These are organic compounds that contain an ester derivative of 3,4,5-trihydroxybenzoic acid.Galloyl estersOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoic acids and derivativesAromatic homomonocyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsBenzoyl derivativesCarboxylic acid estersHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesPolyolsPyrogallols and derivativesm-Hydroxybenzoic acid estersp-Hydroxybenzoic acid alkyl esters1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidAromatic homomonocyclic compoundBenzenetriolBenzoate esterBenzoylCarboxylic acid derivativeCarboxylic acid esterGalloyl esterHydrocarbon derivativeM-hydroxybenzoic acid esterMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundP-hydroxybenzoic acid alkyl esterP-hydroxybenzoic acid esterPhenolPolyolPyrogallol derivativegallate esterlogp1.48logs-1.76solubility3.42e+00 g/lmelting_pointMp 160-162° (anhyd.)logp1.42pka_strongest_acidic8.11pka_strongest_basic-5.5iupacethyl 3,4,5-trihydroxybenzoateaverage_mass198.174mono_mass198.052823422smilesCCOC(=O)C1=CC(O)=C(O)C(O)=C1formulaC9H10O5inchiInChI=1S/C9H10O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,10-12H,2H2,1H3inchikeyVFPFQHQNJCMNBZ-UHFFFAOYSA-Npolar_surface_area86.99refractivity48.77polarizability19.08rotatable_bond_count3acceptor_count4donor_count3physiological_charge0formal_charge0Specdb::MsIr6291Specdb::MsIr6292Specdb::MsIr6293Specdb::MsMs7331Specdb::MsMs7332Specdb::MsMs7333Specdb::MsMs14003Specdb::MsMs14004Specdb::MsMs14005Specdb::MsMs3044788Specdb::MsMs3044789Specdb::MsMs3044790Specdb::MsMs3099460Specdb::MsMs3099461Specdb::MsMs3099462Specdb::CMs1674Specdb::CMs5656Specdb::CMs31633Specdb::CMs43531Specdb::CMs167996Specdb::NmrOneD123158Specdb::NmrOneD123159Specdb::NmrOneD123160Specdb::NmrOneD123161Specdb::NmrOneD123162Specdb::NmrOneD123163Specdb::NmrOneD123164Specdb::NmrOneD123165Specdb::NmrOneD123166Specdb::NmrOneD123167Specdb::NmrOneD123168Specdb::NmrOneD123169Specdb::NmrOneD123170Specdb::NmrOneD123171Specdb::NmrOneD123172Specdb::NmrOneD123173Specdb::NmrOneD123174Specdb::NmrOneD123175Specdb::NmrOneD123176Specdb::NmrOneD123177HMDB33836#<Reference:0x000055567612e158>#<Reference:0x000055567612df50>#<Reference:0x000055567612dd98>FruitsUnknowngenericGrape wineType 2specific1.5351821.5351818261.535181826mg/100 gGuavaType 1specificPsidium guajava120290VinegarType 2specific0.1784780.1784782610.178478261mg/100 ganti methicillin-resistant Staphylococcus aureus447A substance that kills or slows the growth of bacteria.