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8-Geranylapigenin
ScientificNameLabel
8-Geranylapigenin
PHCD compound ID :
2206
Chemical Names :
8-Geranylapigenin
Molecular Formula :
C25H26O5
Molecular Weight :
406.178024
More Details :
Names & Synonyms:
Smiles:
C/C(=C\Cc1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O)/CCC=C(C)C
InChi :
InChI=1S/C25H26O5/c1-15(2)5-4-6-16(3)7-12-19-20(27)13-21(28)24-22(29)14-23(30-25(19)24)17-8-10-18(26)11-9-17/h5,7-11,13-14,26-28H,4,6,12H2,1-3H3/b16-7+
InChi Key :
InChIKey=KMHJTUNINWRWFT-FRKPEAEDSA-N
PubChem ID :
Rotatable bond count :
6
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.008476
Hydrogen bond donor count :
3
Electric dipole moment :
2.861
XLogP :
4.508
VDW volume :
388.773245
Molecular weight :
406.178024
HOMO-LUMO gap :
8.385000
Herb list :
white mulberry - Morus alba - توت سفید، توت هراتی
Refrences & Litretures:
259. Journal:'Fitoterapia' Year:'2010' Volume:'81' Page:'1224' DOI:'10.1016/j. tote.2010.08.006' Title:'Cytotoxic prenylated ?avonoids from Morus alba'
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