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ScientificNameLabel
D-7 avenasterol
PHCD compound ID : 2965
Chemical Names :
Delta7-avenasterol , D-7 avenasterol
Molecular Formula : C29H48O1
Molecular Weight : 412.370516
More Details :
Names & Synonyms: (3S,5S,9R,10S,13R,14R,17R)-17-[(Z,1R)-4-isopropyl-1-methyl-hex-4-enyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol , (3S,5S,9R,10S,13R,14R,17R)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Smiles: C/C=C(\C(C)C)/CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1C2=CC[C@@H]2[C@]1(C)CC[C@@H](C2)O)C
InChi : InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,11,19-20,22-23,25-27,30H,8-10,12-18H2,1-6H3/b21-7-/t20-,22+,23+,25-,26+,27+,28+,29-/m1/s1
InChi Key : InChIKey=MCWVPSBQQXUCTB-OQTIOYDCSA-N
PubChem ID : 12795736
Rotatable bond count : 5 Rule of five : 1
Hydrogen bond acceptor count : 1 Ionization potential : 9.093251
Hydrogen bond donor count : 1 Electric dipole moment : 2.056
XLogP : 10.819 VDW volume : 464.231487
Molecular weight : 412.370516 HOMO-LUMO gap : 10.419000
Herb list :
Refrences & Litretures:
  
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'
436.      Journal:'Chemistry of Natural Compounds'      Year:'2013'      Volume:'49'      Page:'803'      DOI:'10.1007/s10600-013-0752-4'      Title:'INTRODUCING Pistacia khinjuk (KOLKHOUNG) FRUIT HULL OIL AS A VEGETABLE OIL WITH SPECIAL CHEMICAL COMPOSITION AND UNIQUE OXIDATIVE STABILITY'
516.      Journal:'Cogent Food & Agriculture'      Year:'2015'      Volume:'1'      Page:'1018779'      DOI:'10.1080/23311932.2015.1018779'      Title:'Proximate composition of seeds and seed oils from melon (Cucumis melo L.) cultivated in Bulgaria'
551.      Journal:'Food Chemistry'      Year:'2009'      Volume:'113'      Page:'919'      DOI:'10.1016/j.foodchem.2008.08.019'      Title:'Lipid characteristics and essential minerals of native Turkish hazelnut varieties (Corylus avellana L.)'
602.      Journal:'Journal of the Saudi Society of Agricultural Sciences'      Year:'2015'      Volume:''      Page:''      DOI:'10.1016/j.jssas.2015.03.004'      Title:'Chemical characterization and oxidative stability of seeds and oil of sesame grown in Morocco'
817.      Journal:'Int. J. Mol. Sci'      Year:'2011'      Volume:'12'      Page:'8846'      DOI:'10.3390/ijms12128846'      Title:'Compositional Studies: Antioxidant and Antidiabetic Activities of Capparis decidua (Forsk.) Edgew'
988.      Journal:'Grasas y Aceites'      Year:'2013'      Volume:'64'      Page:'77'      DOI:'10.3989/gya.070312'      Title:'Chemical composition of oils from wild almond (Prunus scoparia) and wild pistachio (Pistacia atlantica)'
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