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


and

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




INPUT WORD = C00002501 , 50% or more
[ Metabolite Name : 5,6,7-Trimethoxycoumarin ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00019970 Murrayacarpin B 97.14
C00032667 6,7,8-Trimethoxy-2H-1-benzopyran-2-one
6,7,8-Trimethoxycoumarin		 97.14
C00044065 5,7,8-Trimethoxycoumarin 97.14
C00019318 Fraxinol
5,7-Dimethoxy-6-hydroxycoumarin		 94.29
C00019958 5-Methoxy-6,7-methylenedioxycoumarin 94.29
C00020020 Schinicoumarin 94.29
C00050406 Umckalin 94.29
C00002493 Pimpinellin 92.11
C00031438 Yunngnin A 91.89
C00002479 Leptodactylone 91.43
C00019839 6,8-Dihydroxy-5,7-dimethoxycoumarin 91.43
C00019963 6,7-Methylenedioxy-8-methoxycoumarin 91.43
C00030527 Isofraxidin 91.43
C00031439 Yunngnin B 91.43
C00034050 Malvone A
6-O-Demethyl-3-O-methylancistroquinone B		 91.43
C00038858 Coumarsabin 91.43
C00044478 7,8-Dimethoxy-6-hydroxycoumarin 91.43
C00019766 7-Acetoxy-5,6-dimethoxycoumarin 89.74
C00000583 Isopimpinellin 89.47
C00037863 Suberenone 89.19
C00000576 Xanthotoxin
8-Methoxypsoralen		 88.57
C00002498 Aesculetin dimethyl ether
6,7-Dimethoxycoumarin
Scoparone		 88.57
C00019875 Fraxidin 88.57
C00025292 Ancistroquinone 88.57
C00030108 Demethylsuberosin
7-Demethylsuberosin		 88.57
C00031268 Saikochromone A 88.57
C00033638 Ancistroquinone B 88.57
C00037321 Isobergapten 88.57
C00039442 Isofraxetin 88.57
C00040304 Siderin 88.57
C00046214 Obliquin 86.84
C00002437 Methylripariochromene A 86.49
C00019813 Citrubuntin 86.49
C00019886 Hassanon 86.49
C00026481 Semecarpifoline 86.49
C00033639 Ancistroquinone C 86.49
C00034885 Prenyletin 86.49
C00037864 Suberosin 86.49
C00002146 Casimiroine
Casimiroin		 86.11
C00044385 Wettstein A 86.11
C00050111 Granulosin 86.11
C00000575 5-Methoxypsoralen
Bergaptan
Bergapten		 85.71
C00019803 Buntansin 85.71
C00019920 6-Hydroxymethylherniarin 85.71
C00019944 Kiyomal 85.71
C00019969 Murrayacarpin A 85.71
C00026486 Swietenidine A 85.71
C00037597 Paniculal 85.71
C00038199 2,3,4,5-Tetramethoxybenzoyl chloride 85.71
C00038274 4,6-Dimethoxy-5-methylcoumarin 85.71
C00039177 Eugenetin 85.71
C00044043 1,2,3-Trimethoxynaphthalene 85.71
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