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Citric acid
PHCD compound ID : 1663
Chemical Names :
Citric acid
Molecular Formula : C6H8O7
Molecular Weight : 192.027003
More Details :
Names & Synonyms: citric acid , 2-hydroxypropane-1,2,3-tricarboxylic acid , 2-oxidanylpropane-1,2,3-tricarboxylic acid
Smiles: OC(=O)C(CC(=O)O)(CC(=O)O)O
InChi : InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChi Key : InChIKey=KRKNYBCHXYNGOX-UHFFFAOYSA-N
PubChem ID : 311
Rotatable bond count : 5 Rule of five : 0
Hydrogen bond acceptor count : 7 Ionization potential : 10.986056
Hydrogen bond donor count : 4 Electric dipole moment : 3.226
XLogP : -2.247 VDW volume : 165.954577
Molecular weight : 192.027003 HOMO-LUMO gap : 11.260000
Herb list :
Refrences & Litretures:
  
188.      Journal:'Journal of Pharmaceutical and Biomedical Analysis'      Year:'2013'      Volume:'75'      Page:'158'      DOI:'10.1016/j.jpba.2012.11.023'      Title:'Metabolomic pro?ling of the antitussive and expectorant plant Tussilago farfara L. by nuclear magnetic resonance spectroscopy and multivariate data analysis'
480.      Journal:'Scientia Horticulturae'      Year:'2011'      Volume:'132'      Page:'37'      DOI:'10.1016/j.scienta.2011.09.035'      Title:'Determination of fruit chemical properties of Morus nigra L., Morus alba L. and Morus rubra L. by HPLC'
658.      Journal:'Journal of Ethnopharmacology'      Year:'2007'      Volume:'109'      Page:'177'      DOI:'10.1016/j.jep.2006.09.006'      Title:'Punica granatum (pomegranate) and its potential for prevention and treatment of in?ammation and cancer'
887.      Journal:'Horticulturae'      Year:'2020'      Volume:'6'      Page:'25'      DOI:'10.3390/horticulturae6020025'      Title:'Alterations in the Chemical Composition of Spinach (Spinacia oleracea L.) as Provoked by Season and Moderately Limited Water Supply in Open Field Cultivation'
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