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


and

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





INPUT WORD = C00034327 , 50% or more
[ Metabolite Name : (E)-Sinapic acid , trans-Sinapic acid , 4-Hydroxy-3,5-dimethoxy-(E)-cinnamic acid ]
Number of matched data : 79

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002776 Sinapic acid 100.00
C00034328 Sinapic acid methyl ester
trans-Sinapic acid methyl ester
94.12
C00002775 Sinapaldehyde
Sinapic aldehyde
93.75
C00002778 Sinapyl alcohol 93.75
C00007336 5-Hydroxyferulic acid 93.75
C00031384 Sinapinaldehyde 93.75
C00032286 Taraxafolin
(-)-Taraxafolin
93.75
C00034298 Syringenin 93.75
C00035486 3,4,5-Trimethoxycinnamyl alcohol
3',4',5'-Trimethoxycinnamyl alcohol
93.75
C00030753 Ferulic acid methyl ester
Methyl ferulate
90.63
C00031779 Ethyl ferulate 90.63
C00033558 3,4-Dimethoxy-trans-cinnamic acid
E)-3,4-Dimethoxycinnamic acid
90.63
C00036457 2,4,5-Trimethoxycinnamaldehyde 90.63
C00040817 3-Ethoxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone 90.63
C00048280 3,4-Dimethoxycinnamic acid methyl ester 90.63
C00050393 Plumbagic acid
(+)-Plumbagic acid
90.63
C00031383 Sinapic acid ethyl ester 88.89
C00033516 1,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-2-one 88.24
C00035212 2,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-1-propanone 88.24
C00038199 2,3,4,5-Tetramethoxybenzoyl chloride 88.24
C00002714 Apiol
Parsley apiole
Apiole
87.88
C00002737 Dillapiol 87.88
C00030527 Isofraxidin 87.88
C00001421 N-Methylmescaline 87.50
C00002762 Myristicin 87.50
C00007337 5-Hydroxyconiferyl alcohol
5H-coniferyl alcohol
87.50
C00007611 5-Hydroxyconiferyl aldehyde 87.50
C00029337 (E)-Methyl-4-hydroxy-3-methoxycinnamate
Methyl (E)-ferulate
Methyl trans-ferulate
87.50
C00032014 Methyl syringate 87.50
C00033511 1-(3,4-Dimethoxyphenyl)-1,3-propanediol 87.50
C00034325 (E)-Ferulic acid
E-Ferulic acid
trans-Ferulic acid
4-Hydroxy-3-methoxy-(E)-cinnamic acid
87.50
C00040485 threo-3-Chloro-1-(4-hydroxy-3-methoxyphenyl)propane-1,2-diol
(-)-threo-3-Chloro-1-(4-hydroxy-3-methoxyphenyl)propane-1,2-diol
87.50
C00040946 Dihydroferulic acid 87.50
C00046049 Isoochracinic acid 87.50
C00031732 Descurainolide A
(+)-Descurainolide A
86.49
C00015002 7-Methoxymalbranicin 85.29
C00019963 6,7-Methylenedioxy-8-methoxycoumarin 85.29
C00022793 Drupanin 85.29
C00038323 7-O-Ethylguaiacylglycerol
(-)-7-O-Ethylguaiacylglycerol
85.29
C00002990 Flossonol 84.85
C00019803 Buntansin 84.85
C00036514 3,4-Methylenedioxycinnamylideneacetone 84.85
C00041286 6-Hydroxyindole-3-carboxaldehyde 84.85
C00045658 Aristelegone D
(-)-Aristelegone D
84.85
C00048022 Norruspoline 84.85
C00050406 Umckalin 84.85
C00001419 Mescaline 84.38
C00002473 Fraxetin 84.38
C00002674 Syringic acid
Syringate
4-Hydroxy-3,5-dimethoxybenzoic acid
84.38
C00002686 Acetosyringone 84.38
C00002692 Danielone 84.38
C00002721 Carpacin 84.38
C00002739 Elemicin 84.38
C00002743 Ferulic acid
3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid
Ferulate
84.38
C00002752 Isoferulic acid 84.38
C00002773 1-Allyl-2-methoxy-4,5-methylene-dioxybenzene
Sarisan
Asaricin
84.38
C00002779 Sphagnum acid 84.38
C00014954 NP 25301 84.38
C00016918 (-)-Malbranicin
Malbranicin
84.38
C00029476 Eudesmic acid
3,4,5-Trimethoxybenzoic acid
Trimethylgallic acid
84.38
C00029477 3,4'-Dihydroxy-3'-methoxypropiophenone
3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone
beta-Hydroxypropiovanillone
beta-Hydroxypropiovanillone
omega-Hydroxypropioguaiacone
84.38
C00030221 Ethyl caffeate
Ethyl 3,4-dihydroxy cinnamate
84.38
C00031469 (E)-4-(3,4-dimethoxyphenyl)but-3-en-1-ol
(E)-4-(3,4-Dimethoxyphenyl)-3-buten-1-ol
84.38
C00031720 Danshensu
3,4-Dihydroxyphenyllactic acid
84.38
C00031898 Isoelemicin
(E)-Isoelemicin
84.38
C00032011 Methyl cis-ferulate 84.38
C00034602 Methyl-4-(butyryloxy)benzoate 84.38
C00036526 3,8-Dihydroxy-1,2,4-trimethoxyxanthone 84.38
C00038240 3,4-Dimethoxycinnamaldehyde 84.38
C00040202 Salvianic acid A
(+)-Salvianic acid A
84.38
C00041331 Alcalinaphenol C 84.38
C00041334 Alcalinaphenol F 84.38
C00042109 3,5-Dimethoxytyramine 84.38
C00043176 3-(1-Carboxyvinyloxy)-benzoic acid 84.38
C00045552 3-(2-Formyl-3-hydroxyphenyl)-propionic acid 84.38
C00045560 3-Deoxyisoochracinic acid
(-)-3-Deoxyisoochracinic acid
84.38
C00049489 Morinin G
(-)-Morinin G
84.38
C00050268 Anserinone A 84.38
C00050269 Anserinone B
(+)-Anserinone B
84.38
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