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ScientificNameLabel
Isoorientin-2"-O-rhamnoside
PHCD compound ID : 5668
Chemical Names :
Isoorientin-2"-O-rhamnoside
Molecular Formula : C27H30O15
Molecular Weight : 594.15847
More Details :
Names & Synonyms: 6-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one , 6-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,4S,5R)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1-benzopyran-4-one , 6-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one , 6-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one , 2-[3,4-bis(oxidanyl)phenyl]-6-[(2S,4S,5S)-6-(hydroxymethyl)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]-5,7-bis(oxidanyl)chromen-4-one , 6-[(2S,4S,5S)-4,5-dihydroxy-6-methylol-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromone
Smiles: OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@H](C)[C@@H]([C@@H]([C@H]1O)O)O)c1c(O)cc2c(c1O)c(=O)cc(o2)c1ccc(c(c1)O)O
InChi : InChI=1S/C27H30O15/c1-8-19(33)22(36)24(38)27(39-8)42-26-23(37)20(34)16(7-28)41-25(26)18-13(32)6-15-17(21(18)35)12(31)5-14(40-15)9-2-3-10(29)11(30)4-9/h2-6,8,16,19-20,22-30,32-38H,7H2,1H3/t8-,16-,19+,20-,22+,23+,24-,25+,26-,27+/m1/s1
InChi Key : InChIKey=IUYFTHKQEWZTHY-AJQWZCCBSA-N
PubChem ID : 44257932
Rotatable bond count : 5 Rule of five : 2
Hydrogen bond acceptor count : 15 Ionization potential : 9.299482
Hydrogen bond donor count : 10 Electric dipole moment : 6.660
XLogP : -1.193 VDW volume : 502.727481
Molecular weight : 594.15847 HOMO-LUMO gap : 8.107000
Herb list :
Refrences & Litretures:
  
955.      Journal:'Revista Brasileira de Farmacognosia'      Year:'2015'      Volume:'25'      Page:'134'      DOI:'10.1016/j.bjp.2015.02.008'      Title:'HPLC-DAD-MS/MS profiling of phenolics from Securigera securidaca ?owers and its anti-hyperglycemic and anti-hyperlipidemic activities'
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