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ScientificNameLabel
Beta-carotene
PHCD compound ID : 1765
Chemical Names :
Beta-carotene
Molecular Formula : C40H56
Molecular Weight : 536.438202
More Details :
Names & Synonyms: 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene , 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene
Smiles: C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C1=C(C)CCCC1(C)C)/C)/C)/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C
InChi : InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+
InChi Key : InChIKey=OENHQHLEOONYIE-JLTXGRSLSA-N
PubChem ID : 5280489
Rotatable bond count : 10 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 7.868053
Hydrogen bond donor count : 0 Electric dipole moment : 0.065
XLogP : 14.734 VDW volume : 646.681881
Molecular weight : 536.438202 HOMO-LUMO gap : 7.359000
Herb list :
Refrences & Litretures:
  
197.      Journal:'Food and Nutrition Sciences'      Year:'2015'      Volume:'6'      Page:'1267'      DOI:'10.4236/fns.2015.614132'      Title:'Nutritional Value of Italian Pistachios from Bronte (Pistacia vera, L.), Their Nutrients, Bioactive Compounds and Antioxidant Activity'
309.      Journal:'BioMed Research International'      Year:'2015'      Volume:''      Page:'925631'      DOI:'10.1155/2015/925631'      Title:'Portulaca oleracea L.: A Review of Phytochemistry and Pharmacological Effects'
316.      Journal:'Rev Bras Farmacogn'      Year:'2013'      Volume:'23'      Page:'948'      DOI:''      Title:'Common mullein, pharmacological and chemical aspects'
376.      Journal:'INTERNATIONAL JOURNAL OF NUTRITION'      Year:'2016'      Volume:'1'      Page:'8'      DOI:'10.14302/issn.2379-7835.ijn-14-478'      Title:'Physicochemical and fatty acids composition of Barberry integerrima seed'
511.      Journal:'Fitoterapia'      Year:'2011'      Volume:'82'      Page:'546'      DOI:'10.1016/j.?tote.2011.01.009'      Title:'Phytocomplexes from liquorice (Glycyrrhiza glabra L.) leaves — Chemical characterization and evaluation of their antioxidant, anti-genotoxic and anti-in?ammatory activity'
534.      Journal:'J. Agric. Food Chem'      Year:'2012'      Volume:'60'      Page:'9642'      DOI:'10.1021/jf3026524'      Title:'E?ect of Drying of Jujubes (Ziziphus jujuba Mill.) on the Contents of Sugars, Organic Acids, ??Tocopherol, ??Carotene, and Phenolic Compounds'
535.      Journal:'Journal of Food Composition and Analysis'      Year:'2010'      Volume:'23'      Page:'706'      DOI:'10.1016/j.jfca.2010.02.008'      Title:'Phenolic, alpha-tocopherol, beta-carotene and fatty acid composition of four promising jujube (Ziziphus jujuba Miller) selections'
579.      Journal:'Int J Diabetol Vasc Dis Res'      Year:'2015'      Volume:'3'      Page:'99'      DOI:'10.19070/2328-353X-1500020'      Title:'Pharmacological Properties of Capparis spinosa Linn'
733.      Journal:'Acta Biologica Szegediensis'      Year:'2003'      Volume:'47'      Page:'37'      DOI:''      Title:'HPLC analysis of carotenoids in four varieties of Calendula officinalis L. flowers'
793.      Journal:'Comprehensive Reviews in Food Science and Food Safety'      Year:'2013'      Volume:'12'      Page:'381'      DOI:'10.1111/1541-4337.12021'      Title:'Nutritional Components of Amaranth Seeds and Vegetables: A Review on Composition, Properties, and Uses'
818.      Journal:'International Journal of Phytomedicine'      Year:'2010'      Volume:'2'      Page:'10'      DOI:'10.5138/ijpm.2010.0975.0185.02002'      Title:'Phytochemical and pharmacological Potential of Kair (Capparis Decidua)'
876.      Journal:'Food Chemistry'      Year:'2010'      Volume:'123'      Page:'351'      DOI:'10.1016/j.foodchem.2010.04.042'      Title:'Antioxidants in spring leaves of Oxalis acetosella L'
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