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ScientificNameLabel
cyclocurcumin
PHCD compound ID : 2918
Chemical Names :
cyclocurcumin
Molecular Formula : C21H20O6
Molecular Weight : 368.125988
More Details :
Names & Synonyms: 2-(4-hydroxy-3-methoxy-phenyl)-6-[(E)-2-(4-hydroxy-3-methoxy-phenyl)vinyl]-2,3-dihydropyran-4-one , 2-(4-hydroxy-3-methoxyphenyl)-6-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-2,3-dihydropyran-4-one , 2-(3-methoxy-4-oxidanyl-phenyl)-6-[(E)-2-(3-methoxy-4-oxidanyl-phenyl)ethenyl]-2,3-dihydropyran-4-one
Smiles: COc1cc(/C=C/C2=CC(=O)C[C@H](O2)c2ccc(c(c2)OC)O)ccc1O
InChi : InChI=1S/C21H20O6/c1-25-20-9-13(4-7-17(20)23)3-6-16-11-15(22)12-19(27-16)14-5-8-18(24)21(10-14)26-2/h3-11,19,23-24H,12H2,1-2H3/b6-3+/t19-/m0/s1
InChi Key : InChIKey=IZLBLUIBVMGMIY-NAASZUNDSA-N
PubChem ID : 69879809
Rotatable bond count : 5 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 8.724368
Hydrogen bond donor count : 2 Electric dipole moment : 4.014
XLogP : 1.895 VDW volume : 341.915992
Molecular weight : 368.125988 HOMO-LUMO gap : 7.747000
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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