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ScientificNameLabel
Sinapic
PHCD compound ID : 1389
Chemical Names :
Sinapic acid , Sinapic
Molecular Formula : C11H12O5
Molecular Weight : 224.068473
More Details :
Names & Synonyms: (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoic acid , (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid , (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid , (E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoic acid , (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)acrylic acid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1O)OC
InChi : InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+
InChi Key : InChIKey=PCMORTLOPMLEFB-ONEGZZNKSA-N
PubChem ID : 637775
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 5 Ionization potential : 8.820428
Hydrogen bond donor count : 2 Electric dipole moment : 3.472
XLogP : 1.02 VDW volume : 206.324671
Molecular weight : 224.068473 HOMO-LUMO gap : 7.976000
Herb list :
Refrences & Litretures:
  
148.      Journal:'Crop Protection'      Year:'2002'      Volume:'21'      Page:'913'      DOI:''      Title:'Screening of allelochemicals on barnyardgrass (Echinochloa crus-galli) and identi?cation of potentially allelopathic compounds from rice (Oryza sativa) variety hull extracts'
175.      Journal:'Zeb SpringerPlus'      Year:'2015'      Volume:'4'      Page:'714'      DOI:'10.1186/s40064-015-1514-5'      Title:'Phenolic profile and antioxidant potential of wild watercress (Nasturtium officinale L.)'
260.      Journal:'Agricultural Sciences'      Year:'2013'      Volume:'4'      Page:'141'      DOI:'10.4236/as.2013.45B026'      Title:'Chemical characterization and antioxidative properties of Polish variety of Morus alba L. leaf aqueous extracts from the laboratory and pilot-scale processes'
268.      Journal:'Allelopathy Journal'      Year:'2009'      Volume:'24'      Page:'225'      DOI:''      Title:'Allelopathic Plants. 19. Barley (Hordeum vulgare L)'
475.      Journal:'Int. J. Curr. Microbiol. App. Sci'      Year:'2014'      Volume:'3'      Page:'296'      DOI:''      Title:'Antioxidant activities and phenolic compounds in Bulgarian Fumaria species'
557.      Journal:'J. Agric. Food Chem'      Year:'2005'      Volume:'53'      Page:'8116'      DOI:'10.1021/jf058057y'      Title:'Separation, Characterization, and Quantitation of Phenolic Acids in a Little-Known Blueberry (Vaccinium arctostaphylos L.) Fruit by HPLC-MS'
637.      Journal:'JAOCS'      Year:'2002'      Volume:'79'      Page:'335'      DOI:''      Title:'Phenolic Acids of Borage (Borago officinalis L.) and Evening Primrose (Oenothera biennis L.)'
750.      Journal:'Phytochemistry'      Year:'2009'      Volume:'70'      Page:'924'      DOI:'10.1016/j.phytochem.2009.04.019'      Title:'A comprehensive metabolite profiling of Isatis tinctoria leaf extracts'
820.      Journal:'Not Bot Horti Agrobo'      Year:'2013'      Volume:'41'      Page:'414'      DOI:''      Title:'Chemical Composition of Celandine (Chelidonium majus L.) Extract and its Efects on Botrytis tulipae (Lib.) Lind Fungus and the Tulip'
870.      Journal:'International Journal of Food Studies'      Year:'2020'      Volume:'9'      Page:'146'      DOI:'10.7455/ijfs/9.1.2020.a2'      Title:'Chemical Constituents in Leaves and Aroma Products of Nicotiana rustica L. Tobacco'
885.      Journal:'Food Chemistry'      Year:'2010'      Volume:'120'      Page:'349'      DOI:'10.1016/j.foodchem.2009.09.063'      Title:'The importance of almond (Prunus amygdalus L.) and its by-products'
970.      Journal:'Biocatalysis and Agricultural Biotechnology'      Year:'2019'      Volume:'19'      Page:'101163'      DOI:'10.1016/j.bcab.2019.101163'      Title:'Datura innoxia and Dipsacus laciniatus: Biological activity and phenolic composition'
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