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ScientificNameLabel
Methyl gallate
PHCD compound ID : 3197
Chemical Names :
Methyl gallate
Molecular Formula : C8H8O5
Molecular Weight : 184.037173
More Details :
Names & Synonyms: methyl 3,4,5-trihydroxybenzoate , 3,4,5-trihydroxybenzoic acid methyl ester , methyl 3,4,5-tris(oxidanyl)benzoate
Smiles: COC(=O)c1cc(O)c(c(c1)O)O
InChi : InChI=1S/C8H8O5/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2-3,9-11H,1H3
InChi Key : InChIKey=FBSFWRHWHYMIOG-UHFFFAOYSA-N
PubChem ID : 7428
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 5 Ionization potential : 9.299128
Hydrogen bond donor count : 3 Electric dipole moment : 1.350
XLogP : 1.285 VDW volume : 157.073176
Molecular weight : 184.037173 HOMO-LUMO gap : 8.496000
Herb list :
Refrences & Litretures:
  
443.      Journal:'Food Chemistry'      Year:'2015'      Volume:'166'      Page:'179'      DOI:'10.1016/j.foodchem.2014.06.011'      Title:'HPLC–DAD–ESI-MS/MS screening of bioactive components from Rhus coriaria L. (Sumac) fruits'
645.      Journal:'J. Agric. Food Chem'      Year:'2013'      Volume:'61'      Page:'801'      DOI:'10.1021/jf304002h'      Title:'Chemical Composition, Antioxidative and Anti-In?ammatory Activity of Extracts Prepared from Aerial Parts of Oenothera biennis L. and Oenothera paradoxa Hudziok Obtained after Seeds Cultivation'
943.      Journal:'BMC Complementary and Alternative Medicine'      Year:'2017'      Volume:'17'      Page:'52'      DOI:'10.1186/s12906-017-1561-2'      Title:'Profile of bioactive compounds in Nymphaea alba L. leaves growing in Egypt: hepatoprotective, antioxidant and anti-inflammatory activity'
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