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


and

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




INPUT WORD = C00035911 , 50% or more
[ Metabolite Name : Benzyl hexanoate ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029345 (3Z)-Hexenyl benzoate
cis-Hex-3-enyl benzoate
(Z)-3-Hexen-1-yl benzoate
(Z)-3-Hexenyl benzoate
cis-3-Hexenyl benzoate		 93.33
C00035549 Butyl cinnamate 93.33
C00026382 2-Pentyl-1,2,3,4-tetrahydroquinoline
(R)-2-Pentyl-1,2,3,4-tetrahydroquinoline		 90.32
C00016577 (+)-Sattabacin
Sattabacin		 90.00
C00040015 Pichiacin B 90.00
C00050108 Gibbilimbol C 90.00
C00050109 Gibbilimbol D 90.00
C00002361 Shihunine 87.50
C00024216 Mysorenone B 87.50
C00036094 Cinnamyl isovalerate 87.50
C00040014 Pichiacin A 87.50
C00000116 Indole-3-butyric acid
1H-Indole-3-butanoic acid
IBA		 87.10
C00021313 ar-Himachalene 87.10
C00037211 Goniothalamin
(+)-Goniothalamin		 87.10
C00039142 Eriosematin F
(-)-Eriosematin F		 87.10
C00043462 Dracumerin 87.10
C00045657 Aristelegone C
(-)-Aristelegone C		 87.10
C00031368 Senkyunolide A
(-)-Senkyunolide A		 86.67
C00035906 3',4',5,6,7-Pentahydroxyflavone
Phenylethyl tiglate		 86.67
C00046581 3,4-Dimethoxymethylbenzoate 86.67
C00048327 Benzyl tiglate 86.67
C00026345 (-)-Angustureine
Angustureine		 84.85
C00011626 2-Methyl-6-(4-methylphenyl)-1-hepten-3-one
1,3,5,11-Bisabolatetraen-10-one		 84.38
C00011627 1,3,5-Bisabolatrien-10-one
2-Methyl-6-(4-methylphenyl)-3-heptanone		 84.38
C00016003 Phenethylcarbamic acid butyl ester
TMC 49A		 84.38
C00029766 Baccharisketone 84.38
C00035050 (+)-ar-Dihydroturmerone
ar-Dihydroturmerone		 84.38
C00040817 3-Ethoxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone 84.38
C00020072 (+)-Calamenene
(+)-cis-Calamenene		 83.87
C00020074 Calamenene
(-)-cis-Calamenene
L-Calamenene
(-)-Calamenene		 83.87
C00026590 Paniculidine C 83.87
C00000101 Methyl indole-3-acetate
IAA methyl ester		 83.33
C00000115 Indol-3-propionic acid
1H-Indole-3-propanoic acid		 83.33
C00000328 Capillin 83.33
C00002191 Peganine
Vasicine
(-)-Linarine
(-)-Peganine
(-)-Vasicine		 83.33
C00007580 1-Methoxyindole 3-carboxylic acid methyl ester 83.33
C00015996 (+)-Harzialactone A
Harzialactone A		 83.33
C00016285 (+)-3-Hydroxy-5-(p-hydroxyphenyl)pentanoic acid
Niduloic acid		 83.33
C00025312 Isoshinanolone
(+)-cis-Isoshinanolone
cis-Isoshinanolone		 83.33
C00029489 3-Butylidenephthalide 83.33
C00032553 cis-Ligustilide
Z-Ligustilide		 83.33
C00033677 Bullatenone 83.33
C00034293 Streptopyrrolidine 83.33
C00036969 Cuminyl acetate 83.33
C00037792 S-Benzyl-L-cysteine sulfoxide 83.33
C00041261 2-Hexyl-5-methylresorcinol 83.33
C00041687 N-Butylbenzenesulfonamide 83.33
C00041976 Z-Butylidenephthalide 83.33
C00042589 Hofmeisterin 83.33
C00043490 epi-Isoshinanolone
(+)-epi-Isoshinanolone		 83.33
C00043916 Shinanolone 83.33
C00044014 Winterstein's acid
3-N,N-Dimethyl-3-phenylpropanoic acid		 83.33
C00048195 Terricollene C 83.33
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