1.02011-09-21 00:06:40 UTC2015-10-09 22:33:34 UTCFDB0219933-(3-Hydroxyphenyl)propanoic acid3-(3-Hydroxyphenyl)propanoic (hMPP) acid is one of the major metabolites of ingested caffeic acid (PMID 15479001) and of the phenolic degradation products of proanthocyanidins (the most abundant polyphenol present in chocolate) by the microflora in the colon (PMID 12663291). mHPP is suspected to have antioxidants properties and is actively absorbed by the monocarboxylic acid transporter (MCT) in intestinal Caco-2 cell monolayers (PMID 15479001, 12663291). [HMDB]3-(3-Hydroxy-phenyl)-propanoate3-(3-Hydroxy-phenyl)-propanoic acid3-(3-Hydroxy-phenyl)-propionic acid3-(3-Hydroxyphenyl)propanoate3-(3-Hydroxyphenyl)propanoic acid3-(3-Hydroxyphenyl)propionate3-(3-Hydroxyphenyl)propionic acid3-(m-Hydroxyphenyl)propionate3-(m-Hydroxyphenyl)propionic acid3-Hydroxybenzenepropanoate3-Hydroxybenzenepropanoic acid3-Hydroxydihydrocinnamate3-Hydroxydihydrocinnamic acid3-Hydroxyhydrocinnamic acid3-Hydroxyphenylpropanoate3-Hydroxyphenylpropanoic acid3-Hydroxyphenylpropionate3-Hydroxyphenylpropionic acidb-(3-Hydroxyphenyl)propionateb-(3-Hydroxyphenyl)propionic acidb-(m-Hydroxyphenyl)propionateb-(m-Hydroxyphenyl)propionic acidbeta-(3-Hydroxyphenyl)propionatebeta-(3-Hydroxyphenyl)propionic acidbeta-(m-Hydroxyphenyl)propionatebeta-(m-Hydroxyphenyl)propionic aciddihydro-3-Coumaratedihydro-3-Coumaric acidDihydro-m-coumarateDihydro-m-coumaric acidm-Hydrocoumaric acidm-hydroxy-Hydrocinnamatem-hydroxy-Hydrocinnamic acidm-Hydroxyphenylpropionatem-Hydroxyphenylpropionic acidβ-(m-hydroxyphenyl)propionateβ-(m-hydroxyphenyl)propionic acidC9H10O3166.1739166.0629941863-(3-hydroxyphenyl)propanoic acid3-hydroxyphenylpropionic acid621-54-5OC(=O)CCC1=CC=CC(O)=C1InChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12)QVWAEZJXDYOKEH-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylpropanoic acids. Phenylpropanoic acids are compounds with a structure containing a benzene ring conjugated to a propanoic acid.Phenylpropanoic acidsOrganic compoundsPhenylpropanoids and polyketidesPhenylpropanoic acidsAromatic homomonocyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsBenzene and substituted derivativesCarbonyl compoundsCarboxylic acidsHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxides1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoid3-phenylpropanoic-acidAromatic homomonocyclic compoundBenzenoidCarbonyl groupCarboxylic acidCarboxylic acid derivativeHydrocarbon derivativeMonocarboxylic acid or derivativesMonocyclic benzene moietyOrganic oxideOrganic oxygen compoundOrganooxygen compoundPhenolmonocarboxylic acidSolidlogp1.14logs-1.77solubility2.80e+00 g/llogp1.75pka_strongest_acidic4.21pka_strongest_basic-6iupac3-(3-hydroxyphenyl)propanoic acidaverage_mass166.1739mono_mass166.062994186smilesOC(=O)CCC1=CC=CC(O)=C1formulaC9H10O3inchiInChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12)inchikeyQVWAEZJXDYOKEH-UHFFFAOYSA-Npolar_surface_area57.53refractivity43.95polarizability16.92rotatable_bond_count3acceptor_count3donor_count2physiological_charge-1formal_charge0Specdb::MsIr460Specdb::MsIr461Specdb::MsIr462Specdb::NmrOneD143690Specdb::NmrOneD143691Specdb::NmrOneD143692Specdb::NmrOneD143693Specdb::NmrOneD143694Specdb::NmrOneD143695Specdb::NmrOneD143696Specdb::NmrOneD143697Specdb::NmrOneD143698Specdb::NmrOneD143699Specdb::NmrOneD143700Specdb::NmrOneD143701Specdb::NmrOneD143702Specdb::NmrOneD143703Specdb::NmrOneD143704Specdb::NmrOneD143705Specdb::NmrOneD143706Specdb::NmrOneD143707Specdb::NmrOneD143708Specdb::NmrOneD143709Specdb::CMs5608Specdb::CMs29889Specdb::CMs31859Specdb::CMs37477Specdb::CMs99566Specdb::CMs99567Specdb::CMs155067Specdb::CMs1059869Specdb::CMs1059871Specdb::CMs1059872Specdb::CMs1059874Specdb::CMs1059876Specdb::MsMs26690Specdb::MsMs26691Specdb::MsMs26692Specdb::MsMs33248Specdb::MsMs33249Specdb::MsMs33250Specdb::MsMs2252852Specdb::MsMs2253606Specdb::MsMs2254967Specdb::MsMs2255632Specdb::MsMs2811599Specdb::MsMs2811600Specdb::MsMs2811601Specdb::MsMs2894726Specdb::MsMs2894727Specdb::MsMs2894728HMDB00375#<Reference:0x000055567391b1c0>#<Reference:0x000055567391ac20>#<Reference:0x000055567391a798>#<Reference:0x0000555673919de8>