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


and

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




INPUT WORD = C00029763 , 50% or more
[ Metabolite Name : Aurapten , Auraptene ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002489 Ostruthin 97.78
C00019878 8-Geranyl-7-hydroxycoumarin 97.78
C00019788 Anisocoumarin H 95.74
C00036786 Auraptenol 95.74
C00037062 Diversinin 95.74
C00019932 (+/-)-7-Hydroxy-6-linalycoumarin 95.56
C00019877 8-Geranyl-5,7-dihydroxycoumarin 93.62
C00019896 7-(6R-Hydroxy-3,7-dimethylocta-2,5-dienyl)-7-hydroxycoumarin 93.62
C00019961 (+)-7-(3-Methylbut-2-enyloxy)-8-(4-hydroxy-3-methylbut-2-enyl)coumarin 93.62
C00037141 Ferulagol A 93.62
C00033590 6-Methoxy-7-geranyloxycoumarin
7-O-Geranylscopoletin
6-Methoxyaurapten		 91.84
C00036626 6-Methoxy-7-geranyloxy coumarin 91.84
C00039185 Excavatin A
(+)-Excavatin A		 91.84
C00019785 Anisocoumarin E 91.49
C00019879 4-Geranyloxy-5-methyl coumarin 91.49
C00019960 (+)-7-(3-Methylbut-2-enyloxy)-8-(2-hydroxy-3-methylbut-3-enyl)coumarin 91.49
C00019828 5-Deoxyprotobruceol I regioisomer 91.30
C00019891 (E)-7-(6-Hydroperoxy-3,7-dimethylocta-2,7-dienyloxy)coumarin 89.80
C00037483 Marmin 89.80
C00019786 Anisocoumarin F 89.58
C00019593 Lupichromone
Eriosematin C		 89.36
C00022695 Piloselloidan 89.36
C00033786 Diversin
Diversine		 89.36
C00037142 Ferulagol B 89.36
C00016014 (E)-2-(3,7-Dimethyl-2,6-octadienyl)-4(1H)-quinolinone
CJ 13565		 88.89
C00026409 CID is old! 88.89
C00045665 Artekeiskeanol A 88.24
C00045666 Artekeiskeanol B 88.24
C00029988 Clauslactone M 88.00
C00030243 Excavatin G 88.00
C00036005 3'',4''-Dihydrocapnolactone 88.00
C00039186 Excavatin B
(+)-Excavatin B		 88.00
C00039188 Excavatin D
(+)-Excavatin D		 88.00
C00019787 Anisocoumarin G 87.76
C00022583 Coniferylalcohol-4-O-geranyl ether 86.96
C00030987 Phellopterin 86.96
C00042405 Columbianetin propionate
(+)-Columbianetin propionate		 86.96
C00022794 Artepillin C 86.67
C00037872 Swietenocoumarin B 86.67
C00043350 Capillarin isovalerate 86.67
C00049737 Nocarasin C 86.67
C00019832 6,7-Di-(3,3-dimethylallyloxy)-5-methoxycoumarin 86.27
C00020021 Schinilenol 86.27
C00020022 Schininallylol 86.27
C00019865 (+)-7-(6,7-Epoxy-3,7-dimethyl-5-oxooctanoxy)-coumarin 86.00
C00039187 Excavatin C
(+)-Excavatin C		 86.00
C00002142 Bucharaine 85.71
C00019905 4-[4-Hydroxygeranyloxy]-5-methylcoumarin 85.71
C00019907 4-[10-Hydroxygeranyloxy]-5-methylcoumarin 85.71
C00019926 4-[10-Hydroxyneryloxy]-5-methylcoumarin 85.71
C00019992 4-[10-Oxo-geranyloxyl]-5-methylcoumarin 85.71
C00019993 4-[10-Oxo-neryloxy]-5-methylcoumarin 85.71
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