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Sanggenon K
ScientificNameLabel
Sanggenon K
PHCD compound ID :
2209
Chemical Names :
Sanggenon K
Molecular Formula :
C30H32O6
Molecular Weight :
488.219889
More Details :
Names & Synonyms:
5,7-dihydroxy-2-[5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)chromen-8-yl]-3-(3-methylbut-2-enyl)chromen-4-one , 5,7-dihydroxy-2-[5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-1-benzopyran-8-yl]-3-(3-methylbut-2-enyl)-1-benzopyran-4-one , 3-(3-methylbut-2-enyl)-2-[2-methyl-2-(4-methylpent-3-enyl)-5-oxidanyl-chromen-8-yl]-5,7-bis(oxidanyl)chromen-4-one , 5,7-dihydroxy-2-[5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)chromen-8-yl]-3-(3-methylbut-2-enyl)chromone
Smiles:
CC(=CCC[C@]1(C)C=Cc2c(O1)c(ccc2O)c1oc2cc(O)cc(c2c(=O)c1CC=C(C)C)O)C
InChi :
InChI=1S/C30H32O6/c1-17(2)7-6-13-30(5)14-12-20-23(32)11-10-22(29(20)36-30)28-21(9-8-18(3)4)27(34)26-24(33)15-19(31)16-25(26)35-28/h7-8,10-12,14-16,31-33H,6,9,13H2,1-5H3/t30-/m1/s1
InChi Key :
InChIKey=JDZJUEFVZGTGIJ-SSEXGKCCSA-N
PubChem ID :
44258299
Rotatable bond count :
6
Rule of five :
1
Hydrogen bond acceptor count :
6
Ionization potential :
8.929176
Hydrogen bond donor count :
3
Electric dipole moment :
3.657
XLogP :
5.561
VDW volume :
479.950477
Molecular weight :
488.219889
HOMO-LUMO gap :
8.315000
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'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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