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


and

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





INPUT WORD = C00042776 , 50% or more
[ Metabolite Name : N-Methyl-beta-phenethylamine ]
Number of matched data : 64

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00007327 Phenylacetaldoxime 95.00
C00027432 N-Methyltyramine 90.91
C00042732 Methamphetamine
(+)-Methamphetamine
90.91
C00042759 N,N-Dimethylphenethylamine 90.91
C00001426 Phenethylamine 90.00
C00001435 Tyramine 90.00
C00002725 Cinnamaldehyde 90.00
C00007675 Isothiocyanate 90.00
C00010974 alpha-Cymene
o-Cymol
0-Isopropyltoluene
1-Isopropyl-2-methylbenzene
o-Cymene
2-Isopropyltoluene
90.00
C00029809 Benzenepropanenitrile 90.00
C00032375 (E)-Cinnamic alcohol
trans-Cinnamyl alcohol
(E)-cinnamyl alcohol
90.00
C00032761 Benzyl isothiocyanate
Phenylmethyl isothiocyanate
90.00
C00035115 3-Phenylpropanol
Benzenepropanol
Hydrocinnamic alcohol
90.00
C00035187 (E)-Cinnamaldehyde
trans-Cinnamaldehyde
90.00
C00042226 Amphetamine 90.00
C00042390 Cinnamic alcohol
Cinnamyl alcohol
90.00
C00000157 4-Phenylbutan-2-one 86.36
C00007672 Phenylacetothiohydroximate 86.36
C00018213 p-Hydroxyphenylacetaldoxime 86.36
C00048938 1-Nitro-2-phenylethane 86.36
C00001430 Skatole 85.71
C00049061 1,2-Dihydroisoquinoline 85.71
C00000211 Phenylglyoxal 85.00
C00000621 Chavicol
p-Hydroxyallylbenzene
85.00
C00002636 Anisaldehyde
p-Anisaldehyde
85.00
C00002663 2-Phenylethanol
2-Phenylethyl alcohol
Phenethyl alcohol
Phenylethyl alcohol
beta-Phenethyl alcohol
Benzyl ethyl alcohol
Benzeneethanol
85.00
C00003040 p-Cymene
4-Cymene
85.00
C00007535 Benzeneacetaldehyde
Phenylacetaldehyde
Phenylacetic aldehyde
85.00
C00007546 Methylbenzoate 85.00
C00007674 Phenylacetonitrile 85.00
C00010905 4-Isopropenyl-1-methylbenzene
alpha,4-Dimethylstyrene
p-Cymenene
p-Isopropenyltoluene
p-Isopropenyl toluene
Dehydro-p-cymene
85.00
C00010907 p-Mentha-1,3,8-triene
1,3,8-p-Menthatriene
85.00
C00010967 beta-Cymene
m-Cymene
1-Methyl-3-(1-methylethyl)benzene
1-Isopropyl-3-methylbenzene
85.00
C00029515 2-(4-Hydroxyphenyl)ethanol
4-(2-Hydroxyethyl)phenol
p-Hydroxyphenethyl alcohol
p-Tyrosol
Tyrosol
2-(p-Hydroxyphenyl)ethanol
85.00
C00029532 4-Hydroxy-benzeneacetonitrile
p-Hydroxyphenylacetonitrile
4-Hydroxybenzyl cyanide
85.00
C00034054 Methyl benzoate 85.00
C00036386 1,4-Dimethoxybenzene
1,4-Dimethoxy benzene
85.00
C00039027 2,3-Dihydrobenzofuran
Dihydrobenzofuran
85.00
C00048326 Benzene acetonitrile 85.00
C00001409 L-Ephedrine
Ephedrine
1(R),2(S)-erythro-(-)-Ephedrine
(-)-Ephedrine
83.33
C00001417 Hordenine
Anhalin
Anhaline
Cactine
83.33
C00031097 (+)-Pseudoephedrine
D-pseudoephedrine
Pseudoephedrine
trans-Ephedrine
83.33
C00042777 N-Methyldopamine 83.33
C00026235 4-Methylquinazoline 82.61
C00000170 Cinnamate
trans-Cinnamic acid
trans-Cinnamate
81.82
C00000613 p-Coumaryl alcohol 81.82
C00001405 Cathine
D-Cathine
81.82
C00001406 D-Cathinone 81.82
C00001425 Octopamine 81.82
C00002713 Anethole
(E)-Anethole
81.82
C00002740 Estragol
Methyl chavicol
Estragole
Esdragol
81.82
C00003039 Cuminal
Cumin aldehyde
4-Isopropyl benzaldehyde
Cuminaldehyde
Cuminyl aldehyde
Cumaldehyde
81.82
C00007625 2-Phenylethylaldoxime 81.82
C00010858 4-Isopropenylbenzaldehyde 81.82
C00029334 trans-Anethol
(E)-Anethol
trans-1-(4-Methoxyphenyl)-1-propene
trans-Anethole
81.82
C00029546 4-Vinyl guaiacol
p-Vinylguaiacol
Varamol 106
2-Methoxy-4-vinylphenol
81.82
C00029961 Cinnamic acid
(E)-Cinnamic acid
.beta-Phenylacrylic acid
81.82
C00031014 p-Coumaraldehyde
4-Hydroxycinnamaldehyde
p-Hydroxycinnamaldehyde
p-Coumaroyl aldehyde
81.82
C00032864 Cumin alcohol
p-Cymen-7-ol
Cuminyl alcohol
p-Isopropylbenzyl alcohol
81.82
C00035535 Benzyl acetate 81.82
C00036387 1,4-p-Menthadien-7-ol 81.82
C00037604 p-Cymen-9-ol 81.82
C00042852 p-Hydroxyamphetamine 81.82
C00044952 N-Butylbenzenamine 81.82
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