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ScientificNameLabel
Scaiadopitysin
PHCD compound ID : 2455
Chemical Names :
Scaiadopitysin
Molecular Formula : C33H24O10
Molecular Weight : 580.136947
More Details :
Names & Synonyms: 5,7-dihydroxy-8-[3-hydroxy-2-methoxy-5-(7-methoxy-4-oxo-chromen-2-yl)phenyl]-2-(4-methoxyphenyl)chromen-4-one , 5,7-dihydroxy-8-[3-hydroxy-2-methoxy-5-(7-methoxy-4-oxo-1-benzopyran-2-yl)phenyl]-2-(4-methoxyphenyl)-1-benzopyran-4-one , 5,7-dihydroxy-8-[3-hydroxy-2-methoxy-5-(7-methoxy-4-oxochromen-2-yl)phenyl]-2-(4-methoxyphenyl)chromen-4-one , 8-[2-methoxy-5-(7-methoxy-4-oxidanylidene-chromen-2-yl)-3-oxidanyl-phenyl]-2-(4-methoxyphenyl)-5,7-bis(oxidanyl)chromen-4-one , 5,7-dihydroxy-8-[3-hydroxy-5-(4-keto-7-methoxy-chromen-2-yl)-2-methoxy-phenyl]-2-(4-methoxyphenyl)chromone
Smiles: COc1ccc(cc1)c1cc(=O)c2c(o1)c(c(cc2O)O)c1cc(cc(c1OC)O)c1cc(=O)c2c(o1)cc(cc2)OC
InChi : InChI=1S/C33H24O10/c1-39-18-6-4-16(5-7-18)27-15-25(37)31-24(36)13-23(35)30(33(31)43-27)21-10-17(11-26(38)32(21)41-3)28-14-22(34)20-9-8-19(40-2)12-29(20)42-28/h4-15,35-36,38H,1-3H3
InChi Key : InChIKey=DAOWWUPYZGTYIN-UHFFFAOYSA-N
PubChem ID : 101731765
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 10 Ionization potential : 8.768875
Hydrogen bond donor count : 3 Electric dipole moment : 2.322
XLogP : 2.993 VDW volume : 507.304127
Molecular weight : 580.136947 HOMO-LUMO gap : 7.711000
Herb list :
Refrences & Litretures:
  
280.      Journal:'Appl Microbiol Biotechnol'      Year:'2004'      Volume:'64'      Page:'465'      DOI:'10.1007/s00253-003-1527-9'      Title:'Studies on molecular mechanisms of Ginkgo biloba extract'
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