"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more





INPUT WORD = C00019191 , 50% or more
[ Metabolite Name : Andinermal A , 3-Carboxyaldehyde-4,3'-dihydroxy-6,2',4'-trimethoxy-2-arylbenzofuran ]
Number of matched data : 136

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00019190 Andinermol
3'-Hydroxy-4,6,2',4'-tetramethoxy-3-hydroxymethyl-2-arylbenzofuran
94.44
C00003899 Wightin 94.23
C00004647 Ayanin
3,7,4'-Tri-O-methylquercetin
5,3'-Dihydroxy-3,7,4'-trimethoxyflavone
5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4H-1-benzopyran-4-one
Ayarin
94.23
C00008308 5,3'-Dihydroxy-7,8,4'-trimethoxyflavanone 94.23
C00013330 Lethedocin
5-Hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
94.23
C00019192 Andinermal C
3-Carboxyaldehyde-4,3',4'-trihydroxy-6,2'-dimethoxy-2-arylbenzofuran
94.23
C00004107 5-Hydroxy-7,2',4'-trimethoxy-3',6'-diketoflavone 92.59
C00005047 5-Hydroxy-3,7-dimethoxy-3',4'-methylenedioxyflavone 92.45
C00009702 Bryacarpene 1
4,10-Dihydroxy-3,8,9-trimethoxypterocarpene
92.45
C00003845 Eupatilin
2-(3,4-Dimethoxyphenyl)-5,7-dihydroxy-6-methoxy-4H-1-benzopyran-4-one
92.31
C00003862 Norartocarpetin 5,7,2',4'-tetramethyl ether 92.31
C00003910 Hypolaetin 8,3',4'-trimethyl ether
5,7-Dihydroxy-8,3',4'-trimethoxyflavone
3',4'-Dimethoxywogonin
2-(3,4-Dimethoxyphenyl)-5,7-dihydroxy-8-methoxy-4H-1-benzopyran-4-one
92.31
C00003916 Tricetin 3',4',5'-trimethyl ether
5,7-Dihydroxy-3',4',5'-trimethoxyflavone
5,7-Dihydroxy-2-(3,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one
92.31
C00004077 8,3'-Dihydroxy-7,4',5'-trimethoxyflavone 92.31
C00004620 Herbacetin 3,7,4'-trimethyl ether 92.31
C00004648 Quercetin 3,3',4'-trimethyl ether
5,7-Dihydroxy-3,3',4'-trimethoxyflavone
2-(3,4-Dimethoxyphenyl)-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one
92.31
C00004730 Gossypetin 7,4'-dimethyl ether 92.31
C00004766 Myricetin 7,4'-dimethyl ether 92.31
C00006619 Hirsutidin 92.31
C00008355 Cerasinone 92.31
C00008356 Arjunone 92.31
C00008363 Breverin 92.31
C00008582 Taxifolin 7,4'-dimethyl ether
(2R,3R)-3,5,3'-Trihydroxy-7,4'-dimethoxyflavanone
92.31
C00008588 Dihydrogossypetin 7,8-dimethyl ether 92.31
C00009699 Bryacarpene 4
4-Hydroxy-3,9,10-trimethoxypterocarpene
92.31
C00010244 7,3'-Dihydroxy-5,4'-dimethoxy-6-formyl-4-phenylcoumarin 92.31
C00013333 5,5'-Dihydroxy-8,3',4'-trimethoxyflavone
5-Hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-8-methoxy-4H-1-benzopyran-4-one
92.31
C00013399 Millettocalyxin A
7-Methoxy-2-(6-methoxy-1,3-benzodioxol-5-yl)-4H-1-benzopyran-4-one
92.31
C00013510 2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-6-methyl-4H-1-benzopyran-4-one 92.31
C00014134 5,2'-Dihydroxy-7,4',5'-trimethoxyflavanone 92.31
C00003897 6-Hydroxyluteolin 5,6,3',4'-tetramethyl ether
7-Hydroxy-3',4',5,6-tetramethoxyflavone
90.74
C00003898 5-Hydroxy-6,7,3',4'-tetramethoxyflavone
6-Hydroxyluteolin 6,7,3',4'-tetramethyl ether
2-(3,4-Dimethoxyphenyl)-5-hydroxy-6,7-dimethoxy-4H-1-benzopyran-4-one
90.74
C00003900 2-(2,4-dimethoxyphenyl)-5-hydroxy-7,8-dimethoxyflavone 90.74
C00003917 Corymbosin
5-Hydroxy-3',4',5',7-tetramethoxyflavone
5-Hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one
90.74
C00004081 5,7,3'-Trihydroxy-2',4',5'-trimethoxyflavone
5,7-Dihydroxy-2-(3-hydroxy-2,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one
90.74
C00004651 Quercetin 3,5,7,4'-tetramethyl ether 90.74
C00004653 5-Hydroxy-3,7,3',4'-tetramethoxyflavone
Retusin(Ariocarpus)
Quercetin 3,7,3',4'-tetramethyl ether
Retusine
2-(3,4-Dimethoxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-1-benzopyran-4-one
Retusin
90.74
C00004696 Oxyayanin-B 90.74
C00004698 Eupatin 90.74
C00004773 Myricetin 7,3',4'-trimethyl ether 90.74
C00005113 Pulcherrimin
7-Hydroxy-9-methoxy-1,3-dioxolo[7,8][2]benzopyrano[4,3-b][1]benzopyran-6(4H)-one
90.74
C00008310 Agestricin C 90.74
C00008360 5-Hydroxy-7,3',4',5'-tetramethoxyflavanone 90.74
C00008416 5-Hydroxy-6,7,3',4'-tetramethoxyflavanone 90.74
C00008535 Heteroflavanone A 90.74
C00009701 Leiocalycin
2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxypterocarpene
90.74
C00013319 5-Hydroxy-2',3',7,8-tetramethoxyflavone
2-(2,3-Dimethoxyphenyl)-5-hydroxy-7,8-dimethoxy-4H-1-benzopyran-4-one
90.74
C00013401 2-(1,3-Benzodioxol-5-yl)-5-hydroxy-6,8-dimethoxy-4H-1-benzopyran-4-one 90.57
C00019504 Kashmigenin
4'-Hydroxy-3',5'-dimethoxy-6,7-methylenedioxyisoflavone
90.57
C00001075 Nevadensin 90.38
C00001096 Santin 90.38
C00001104 Tambulin 90.38
C00003854 Isoscutellarein 7,8,4'-trimethyl ether
5-Hydroxy-4',7,8-trimethoxyflavone
5-Hydroxy-7,8,4'-trimethoxyflavone
5-Hydroxy-7,8-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00003861 Noratocarpetin 7,2',4'-trimethyl ether 90.38
C00003870 5-Hydroxy-7,3',4'-trimethoxyflavone
Luteolin 7,3',4'-trimethyl ether
2-(3,4-Dimethoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
90.38
C00003871 5,7,3',4'-Tetramethoxyflavone
Luteolin 5,7,3',4'-tetramethyl ether
90.38
C00003891 Desmethoxycentaureidin
5,7,3'-Trihydroxy-6,4'-dimethoxyflavone
Demethoxycentaureidin
5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6-methoxy-4H-1-benzopyran-4-one
90.38
C00003915 Apometzgerin
Tricetin 3',4'-dimethyl ether
5,7-Dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00003941 5,3',4',5'-Tetrahydroxy-6,7-dimethoxyflavone 90.38
C00003958 5,7,3',5'-Tetrahydroxy-8,4'-dimethoxyflavone 90.38
C00003999 6,7-Dimethoxy-3',4'-methylenedioxyflavone
Milletenin C
2-(1,3-Benzodioxol-5-yl)-6,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00004072 7,2',4',5'-Tetramethoxyflavone 90.38
C00004584 3,3',4',7-Tetramethoxyflavone
3,7,3',4'-Tetramethoxyflavone
Fisetin tetramethyl ether
90.38
C00004602 6-Hydroxykaempferol 3,5,7-trimethyl ether 90.38
C00004603 Penduletin
5,4'-Dihydroxy-3,6,7-trimethoxyflavone
5-Hydroxy-2-(4-hydroxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one
90.38
C00004606 Mikanin
3,5-Dihydroxy-4',6,7-trimethoxyflavone
3,5-Dihydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00004619 Herbacetin 3,7,8-trimethyl ether
5,4'-Dihydroxy-3,7,8-trimethoxyflavone
5-Hydroxy-2-(4-hydroxyphenyl)-3,7,8-trimethoxy-4H-1-benzopyran-4-one
90.38
C00004621 Herbacetin 3,8,4'-trimethyl ether
5,7-Dihydroxy-3,8,4'-trimethoxyflavone
3,8,4'-Trimethylherbacetin
5,7-dDihydroxy-3,8-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00004626 Morin 3,2',4'-trimethyl ether 90.38
C00004638 Quercetin 3,7-dimethyl ether
5,3',4'-Trihydroxy-3,7-dimethoxyflavone
2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-1-benzopyran-4-one
3,7-Di-O-methylquercetin
90.38
C00004640 Quercetin 3,4'-dimethyl ether
5,7,3'-Trihydroxy-3,4'-dimethoxyflavone
5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-4H-1-benzopyran-4-one
90.38
C00004643 Ombuin
3,5,3'-Trihydroxy-7,4'-dimethoxyflavone
4',7-Dimethylquercetin
3,5-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
90.38
C00004645 Quercetin 3,5,3'-trimethyl ether 90.38
C00004646 Pachypodol
5,4'-Dihydroxy-3,7,3'-trimethoxyflavone
Quercetin 3,3',7-trimethyl ether
5-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00004685 5,6,3',4'-Tetrahydroxy-3,7-dimethoxyflavone
Tomentin
3,7-Dimethylquercetagetin
2-(3,4-Dihydroxyphenyl)-5,6-dihydroxy-3,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00004687 Quercetagetin 3,4'-dimethyl ether
5,6,7,3'-Tetrahydroxy-3,4'-dimethoxyflavone
5,6,7-Trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-4H-1-benzopyran-4-one
90.38
C00004688 Eupatoletin
Eupatolitin
3,3',4',5-tetrahydroxy-6,7-dimethoxyflavone
2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00004726 Gossypetin 3,7-dimethyl ether
5,8,3',4',-Tetrahydroxy-3,7-dimethoxyflavone
2-(3,4-Dihydroxyphenyl)-5,8-dihydroxy-3,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00004764 Myricetin 3,4'-dimethyl ether 90.38
C00004887 8-Desmethylkalmiatin 90.38
C00004890 5,8,4'-Trihydroxy-3,7-dimethoxy-6-methylflavone 90.38
C00004898 6-C-Methylquercetin 3,3'-dimethyl ether 90.38
C00005045 Demethoxykanugin
2-(1,3-Benzodioxol-5-yl)-3,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00006966 Cerasidin 90.38
C00008255 5-Hydroxy-7,8,4'-trimethoxyflavanone 90.38
C00008314 3'-Hydroxy-5,7,4'-trimethoxy-8-C-methylflavanone 90.38
C00008344 Dihydrotricetin 7,3'-dimethyl ether 90.38
C00008349 Eriodictyol 7,3',4'-trimethyl ether 90.38
C00008365 Remerin 90.38
C00008395 7,2'-Dimethoxy-4',5'-methylenedioxyflavanone 90.38
C00008398 6,7-Dimethoxy-3',4'-methylenedioxyflavanone 90.38
C00008488 5-Hydroxy-7,3',4'-trimethoxy-6-C-methylflavanone 90.38
C00008589 3,5,7,3'-Tetrahydroxy-8,4'-dimethoxyflavanone 90.38
C00008739 (2R,3R)-Aromadendrin 7-methyl ether 3-acetate 90.38
C00008815 Epicatechin 5,7,3'-trimethyl ether 90.38
C00008829 3',4'-Methylenedioxy epicatechin 5,7-dimethyl ether 90.38
C00009417 7,2',4',5'-Tetramethoxyisoflavone 90.38
C00009633 4-Hydroxy-2,3,9-trimethoxypterocarpan 90.38
C00009698 Bryacarpene 2
10-Hydroxy-3,8,9-trimethoxypterocarpene
90.38
C00009706 Bryaquinone 90.38
C00010000 Melilotocarpan C
4-Hydroxy-3,9,10-trimethoxypterocarpan
90.38
C00013301 6-Hydroxy-5,7,4'-trimethoxyflavone
6-Hydroxy-5,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00013302 5-Hydroxy-2',7,8-trimethoxyflavone
Andrographin
Skullcapflavone I 2'-methyl ether
2'-O-Methylskullcapflavone I
5-Hydroxy-7,8-dimethoxy-2-(2-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00013306 5-Hydroxy-7,2',5'-trimethoxyflavone
2-(2,5-Dimethoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
90.38
C00013307 5,7,2',5'-tetramethoxyflavone
2-(2,5-Dimethoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00013322 5,7-Dihydroxy-8,3',5'trimethoxyflavone
2-(3,5-Dimethoxyphenyl)-5,7-dihydroxy-8-methoxy-4H-1-benzopyran-4-one
90.38
C00013332 5,4'-dihydroxy-7,3',5'-trimethoxyflavone
5-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
90.38
C00013350 3,5,7,4'-Tetramethoxyflavone
O-Tetramethylkaempferol
Tetramethylkaempferol
2-(4-Methoxyphenyl)-3,5,7-trimethoxy-4-oxo-4H-1-benzopyran
3,5,7-Trimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00013354 5,6-Dihydroxy-3,7,4'-trimethoxyflavone
6-Hydroxykaempferol 3,7,4'-trimethyl ether
Tanetin
5,6-Dihydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
90.38
C00013357 3,7-Dihydroxy-5,3',4'-trimethoxyflavone
2-(3,4-Dimethoxyphenyl)-3,7-dihydroxy-5-methoxy-4H-1-benzopyran-4-one
90.38
C00013363 3,4'-Dihydroxy-7,3',5'-trimethoxyflavone
3-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
90.38
C00013368 Zanthoxyl flavone
2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-7,8-dimethoxy-4H-1-benzopyran-4-one
90.38
C00013398 3',4'-Methylenedioxy-5,7-dimethoxyflavone
5,7-Dimethoxy-3',4'-methylenedioxyflavone
2-(1,3-Benzodioxol-5-yl)-5,7-dimethoxy-4H-1-benzopyran-4-one
90.38
C00013400 7,8-Dimethoxy-3',4'-methylenedioxyflavone
2-(1,3-Benzodioxol-5-yl)-7,8-dimethoxy-4H-1-benzopyran-4-one
90.38
C00013509 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-6,8-dimethyl-4H-1-benzopyran-4-one 90.38
C00014128 (2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone 90.38
C00014129 (2R)-5-Hydroxy-7,2',3'-trimethoxyflavanone 90.38
C00014130 5,7,2',5'-Tetramethoxyflavanone 90.38
C00014367 3,5,3'-Trihydroxy-7,2'-dimethoxyflavanone 90.38
C00014368 (2R,3S)-3,5,3'-Trihydroxy-7,4'-dimethoxyflavanone 90.38
C00014376 (2R,3S)-5,4'-Dihydroxy-7-methoxy-3-O-acetylflavanone 90.38
C00015288 3,3'-Dihydroxy-4,5'-dimethoxy-2-isopentenylbibenzyl
Canniprene
90.38
C00019252 Oryzafuran 90.38
C00019759 1,7-Dihydroxy-3,9-dimethoxypterocarpene 90.38
C00020652 Milletenin A 90.38
C00029730 Artoindonesianin E 90.38
C00034396 5,7,3',4'-Tetramethoxyflavanone 90.38
C00034930 Artomunoflavanone
(+)-Artomunoflavanone
90.38
C00034954 Pongamone D 90.38
C00035952 5,7,2',3'-Tetramethoxyflavone 90.38
C00035968 7,2',3',4'-Tetramethoxyflavone 90.38
C00039618 Lespedezavirgatal 90.38
C00041876 Spinosan A 90.38
C00046037 Irisflavone B 90.38
C00046039 Irisflavone D 90.38
C00047948 Khrinone C 90.38
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