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


and

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




INPUT WORD = C00009790 , 50% or more
[ Metabolite Name : Robustin methyl ether ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010047 Isorobustin 4-methyl ether
4-O-Methylisorobustin		 96.88
C00009789 Robustin 95.31
C00009791 Glabrescin 95.31
C00009913 5-Methoxydurmillone
5,6-Dimethoxy-3',4'methylenedioxy-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone		 93.75
C00010046 Isorobustin 93.75
C00019586 (-)-13alpha-Hydroxydeguelin 93.75
C00029676 alpha-Toxicarol
(-)-alpha-Toxicarol		 93.75
C00010044 Thonningine A 92.42
C00007014 Pongapinone A 92.19
C00009445 Ferrugone 92.19
C00009446 Ichthynone 92.19
C00009508 Robustone methyl ether 92.19
C00009517 Toxicarolisoflavone 92.19
C00009788 Robustic acid methyl ether
Methyl robustate
O-Methylrobustic acid		 92.19
C00010045 Thonningine B 92.19
C00018978 (R)-Saclenone
(R)-5-Hydroxy-2',4',5'-trimethoxy-2'',2''-dimethylpyrano[5'',6'':6,7]isoflavanone		 92.19
C00019489 3',4'-Methlenedioxy-8-methoxy-5-hydroxy-6'',6''-dimethylchromeno-[2'',3'':7,6]-isoflavone 92.19
C00032368 Toxicarol isoflavone 92.19
C00002580 Toxicarol
alpha-Toxicarol
Toxicarin		 90.63
C00005085 3,6-Dimethoxy-6'',6''-dimethyl-3',4'-methylenedioxypyrano[2,3:7,8]flavone 90.63
C00009512 Elongatin 90.63
C00019050 (+)-12a-Epimillettosin
(6aS,12aS)-12a-Hydroxy-2,3-methylenedioxy-6',6'-dimethoxypyr[2',3':9,8]rotenone		 90.63
C00019073 Griffonianone B
6-Hydroxy-5-methoxy-3',4'-methylenedioxy-6'',6''-dimethylpyrano[2'',3'',7,6]isoflavone		 90.63
C00019075 2',4',5'-Trimethoxy-6'',6''-dimethylpyrano[2'',3'':7,6]isoflavone 90.63
C00019150 Pervilleanine
2'-Methoxy-3',4'-methylenedioxy-6'',6''-dimethylpyrano[2'',3'':7,6]-3-phenylcoumarin		 90.63
C00019668 4'-Demethyltoxicarol
5,4'-Dihydroxy-2',5'-dimethoxy-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone		 90.63
C00038633 Brandisianin D
(-)-Brandisianin D		 90.63
C00009591 11-Hydroxytephrosin 89.39
C00004067 7,8,3',4'-Tetramethoxy-6'',6''-dimethylpyrano[2'',3'':5,6]flavone 89.23
C00009519 Isoauriculatin 89.23
C00009520 Isoauriculasin 89.23
C00002522 Deguelin
(-)-cis-Deguelin		 89.06
C00002550 Millettone 89.06
C00004048 5-Methoxy-6'',6''-dimethyl-3',4'-methylenedioxypyrano[2'',3'':7,8]flavone 89.06
C00005082 Pongachromene
3-Methoxy-8,8-dimethyl-2-[3,4-(methylenedioxy)phenyl]-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
2-(1,3-Benzodioxol-5-yl)-3-methoxy-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one		 89.06
C00009440 Jamaicin 89.06
C00009441 Durmillone 89.06
C00009444 Barbigerone
Lonchocarpusone		 89.06
C00009503 Robustone 89.06
C00009509 Glabrescione A 89.06
C00009513 Chandalone 89.06
C00009587 Millettosin
12a-Hydroxymillettone		 89.06
C00009605 Dehydrotoxicarol
7a,13a-Didehydrotoxicarol		 89.06
C00009661 Desmodin 89.06
C00009787 Robustic acid 89.06
C00009886 Isojamaicin
3'-Methoxy-4',5'-methylenedioxy-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone		 89.06
C00009893 Pumilaisoflavone D 89.06
C00009912 Pre-5-methoxydurmillone
7-Hydroxy-5,6-dimethoxy-3',4'-methylenedioxy-8-prenylisoflavone		 89.06
C00013270 3beta,4beta,5-Trimethoxy-4'-hydroxy- (6:7)-2,2-dimethylpyranoflavan 89.06
C00013440 5-Hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one 89.06
C00019079 Scanderone
4',5-Dihydroxy-3'-prenyl-2'',2''-dimethylchromeno[7,8:6'',5'']isoflavone		 89.06
C00019479 (E)-3,4-Methylenedioxy-2'-methoxy-6'',6''-dimethylchromeno-[2'',3'':4',3']-9-methoxychalcone 89.06
C00019480 (Z)-3,4-Methylenedioxy-2'-methoxy-6'',6''-dimethylchromeno-[2'',3'':4',3']-9-methoxychalcone 89.06
C00019484 3,4-Methylenedioxy-2'-methoxy-6'',6''-dimethlchromeno-[2'',3'':4',3']-beta-hydroxychalcone 89.06
C00038631 Brandisianin B
(-)-Brandisianin B		 89.06
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