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


and

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




INPUT WORD = C00001274 , 50% or more
[ Metabolite Name : 5-(3-Buten-1-ynyl)2,2'-bithienyl ]
Number of matched data : 64

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00001294 alpha-Terthienyl 84.38
C00045655 Aristelegone A
(+)-Aristelegone A		 79.31
C00021948 Dihydropalutropone 75.86
C00027481 CID is old! 75.86
C00032553 cis-Ligustilide
Z-Ligustilide		 75.86
C00043957 Tambjamine A 75.86
C00002715 beta-Asarone 73.33
C00024674 3-Chlorocarbazole 73.33
C00031469 (E)-4-(3,4-dimethoxyphenyl)but-3-en-1-ol
(E)-4-(3,4-Dimethoxyphenyl)-3-buten-1-ol		 73.33
C00040614 Valencic acid 73.33
C00047666 4-(3-Methoxy-4-hydroxy)phenyl-3-methyl-3-buten-2-one 73.33
C00049685 Zanthonitrile 73.33
C00001865 Heliamine 72.41
C00002149 Deoxyvasicine
Deoxypeganine
Deoxypeganine N-oxide		 72.41
C00002155 Echinorine 72.41
C00010863 Thymohydroquinone dimethyl ether
Thymoquinol dimethyl ether
4-Hydroxythymol dimethyl ether		 72.41
C00022591 3,4-Dimethoxypropiophenone 72.41
C00022646 7-Methoxy-1-methyltetralin 72.41
C00024693 Carbazole 72.41
C00025829 Corypalline 72.41
C00026389 1-Methyl-4-methoxy-2-quinolone
4-Methoxy-1-methyl-2-quinolone
N-Methyl-4-methoxycarbostyril		 72.41
C00026807 6-Prenylindole
6-(3-Methyl-2-butenyl)indole		 72.41
C00027140 Dihydrobackebergine
3,4-Dihydro-6,7-dimethoxyisoquinoline
3,4-Dihydrobackebergine
6,7-Dimethoxy-3,4-dihydroisoquinoline		 72.41
C00029489 3-Butylidenephthalide 72.41
C00031368 Senkyunolide A
(-)-Senkyunolide A		 72.41
C00034398 5-Methoxy-1-naphthalenol 72.41
C00038240 3,4-Dimethoxycinnamaldehyde 72.41
C00041976 Z-Butylidenephthalide 72.41
C00042775 N-Methyl-3,4-dimethoxyphenethylamine 72.41
C00043916 Shinanolone 72.41
C00044407 (4S)-Shinanolone
(+)-(4S)-Shinanolone		 72.41
C00011450 (E,E)-2-(2,6-Dimethyl-1,5,7-octatrienyl)-4-methylfuran 71.88
C00000736 1,4-Dihydroxy-2-naphthoic acid 70.97
C00002395 Dehydrotremetone 70.97
C00011948 Isofurocaespitane
[1S-(1alpha,3beta,4alpha)]-3-(4-Bromo-3-chloro-4-methylcyclohexyl)-2-methyl-furan		 70.97
C00019920 6-Hydroxymethylherniarin 70.97
C00020170 Lacinilene A 70.97
C00022165 (3E,7E)-4,8,12-Trimethyl-1,3,7,11-tridecatetraene
(E,E)-4,8,12-Trimethyl-1,3,7,11-tridecatetraene
4,8,12-Trimethyl-1,3E,7E,11-tridecatetraene		 70.97
C00024184 Cladobotrin I 70.97
C00026423 Edulitine
Robustinin
Robustinine		 70.97
C00030982 Phellodenol A 70.97
C00037986 Vetivazulene
Elemazulene		 70.97
C00042065 2,2-Dimethyl-6-methoxy-4-chromanone 70.97
C00043462 Dracumerin 70.97
C00001699 Calligonine 70.00
C00001736 1-Methyl-beta-carboline
Harman
Harmane
Indoter
Locuturin
Zygofabagine		 70.00
C00002150 Deoxyvasicinone 70.00
C00002775 Sinapaldehyde
Sinapic aldehyde		 70.00
C00002778 Sinapyl alcohol 70.00
C00003122 (S)-(+)-Curcumene
(S)-alpha-Curcumene		 70.00
C00003204 alpha-Zingiberene
Zingiberene
(-)-Zingiberene
l-Zingiberene		 70.00
C00007330 Camalexin 70.00
C00011893 [S-(R*,S*)]- 3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexen-1-one 70.00
C00012011 delta-Elemene 70.00
C00031384 Sinapinaldehyde 70.00
C00033511 1-(3,4-Dimethoxyphenyl)-1,3-propanediol 70.00
C00033558 3,4-Dimethoxy-trans-cinnamic acid
E)-3,4-Dimethoxycinnamic acid		 70.00
C00034298 Syringenin 70.00
C00035241 9,10-Dihydrophenanthrene 70.00
C00041261 2-Hexyl-5-methylresorcinol 70.00
C00042219 alpha-Asarone 70.00
C00042628 Isoasarone 70.00
C00046160 MKN-003B 70.00
C00047149 4-(4'-Hydroxy-3'-methylbutoxy)benzaldehyde 70.00
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