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ScientificNameLabel
Lycopene
PHCD compound ID : 4647
Chemical Names :
Lycopene
Molecular Formula : C40H56
Molecular Weight : 536.438202
More Details :
Names & Synonyms: (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene
Smiles: C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C=C(\CCC=C(C)C)/C)/C)/C)/C=C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C
InChi : InChI=1S/C40H56/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-22,25-32H,13-14,23-24H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,32-18+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
InChi Key : InChIKey=OAIJSZIZWZSQBC-GYZMGTAESA-N
PubChem ID : 446925
Rotatable bond count : 16 Rule of five : 2
Hydrogen bond acceptor count : 0 Ionization potential : 8.094033
Hydrogen bond donor count : 0 Electric dipole moment : 1.156
XLogP : 14.586 VDW volume : 666.121881
Molecular weight : 536.438202 HOMO-LUMO gap : 7.735000
Herb list :
Refrences & Litretures:
  
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'
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