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ScientificNameLabel
Curcumin II
PHCD compound ID : 2904
Chemical Names :
Curcumin II
Molecular Formula : C20H18O5
Molecular Weight : 338.115424
More Details :
Names & Synonyms: (1E,6E)-1-(4-hydroxy-3-methoxy-phenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione , (1E,6E)-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione , (1E,6E)-1-(4-hydroxyphenyl)-7-(3-methoxy-4-oxidanyl-phenyl)hepta-1,6-diene-3,5-dione
Smiles: COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(cc2)O)ccc1O
InChi : InChI=1S/C20H18O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-12,21,24H,13H2,1H3/b9-4+,10-5+
InChi Key : InChIKey=HJTVQHVGMGKONQ-LUZURFALSA-N
PubChem ID : 5469424
Rotatable bond count : 7 Rule of five : 0
Hydrogen bond acceptor count : 5 Ionization potential : 8.977337
Hydrogen bond donor count : 2 Electric dipole moment : 3.508
XLogP : 1.916 VDW volume : 325.54978
Molecular weight : 338.115424 HOMO-LUMO gap : 7.911000
Herb list :
Refrences & Litretures:
  
371.      Journal:'Pharmaceutical Crops'      Year:'2011'      Volume:'2'      Page:'28'      DOI:''      Title:'Chemical composition and product quality control of turmeric (Curcuma longa L.)'
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