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


and

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




INPUT WORD = C00010998 , 50% or more
[ Metabolite Name : beta-Cyclolavandulal , 2,4,4-Trimethyl-1-cyclohexene-1-carboxyaldehyde ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00042278 beta-Cyclocitral 95.45
C00000827 Pulegone
(+)-Pulegone
(+)-(R)-Pulegone		 90.91
C00010871 (-)-Perilla aldehyde
(S)-(-)-Perillaldehyde		 90.91
C00010936 p-Menth-4(8)-en-3-ol
(-)-cis-Pulegol		 90.91
C00010946 S-(-)-Pulegone 90.91
C00011006 5,5-Dimethyl-1,3-cyclopeptadienecarboxylic acid 87.50
C00031537 2,6,6-Trimethyl-4-hydroxy-1-cyclohexene-1-carboxaldehyde 87.50
C00000863 R-(+)-trans-Verbenol 86.96
C00011049 Car-3-en-5-one 86.96
C00029977 cis-Verbenol 86.96
C00000810 (-)-Menthol 86.36
C00000811 (-)-Menthone 86.36
C00000820 (+)-cis-Isopulegone
(2R-cis)-5-methyl-2-(1-methylethenyl)-cyclohexanone		 86.36
C00000822 (+)-Isomenthol 86.36
C00000824 (+)-Neoisomenthol 86.36
C00000825 (+)-Neomenthol 86.36
C00000855 beta-Nerol
Nerol
cis-Geraniol
(Z)-Geraniol		 86.36
C00010282 alpha-Clausenan 86.36
C00010348 Tetrahydro-2,2-dimethyl-5-(1-methyl-1-propenyl)furan 86.36
C00010470 Junionone 86.36
C00010802 4-Isopropenyl-1-cyclopenten-1-yl methyl ketone
1-Acetyl-4-isopropenylcyclopentene		 86.36
C00010881 trans-p-Mentha-1(7),8-dien-3-ol 86.36
C00010885 (S)-(-)-Perilla alcohol
(S)-(-)-Perillyl alcohol		 86.36
C00010889 Piperitenone
p-Mentha-1,4(8)-dien-3-one
Pulespenone
3-Terpinolenone		 86.36
C00010902 (+)-Isomenthone 86.36
C00010903 (+)-Menthone 86.36
C00010904 (-)-Isomenthone 86.36
C00010938 Isopulegol
(-)-Isopulegol		 86.36
C00010939 (+)-Neoisopulegol 86.36
C00010940 trans-p-Menth-8-en-7-ol
trans-Shisool		 86.36
C00010948 (+)-Isopulegone
(2R-trans)-5-methyl-2-(1-methylethenyl)-cyclohexanone		 86.36
C00032859 Crocusatin A
S-Phorenol		 86.36
C00032863 beta-Isophorone
Crocusatin E
beta-Phorone		 86.36
C00035118 Isomenthol 86.36
C00035341 Menthone 86.36
C00035537 beta-Isocyclolavandulol 86.36
C00035737 Safranal 86.36
C00036497 2-Isopropenyl-5-methylhexa-trans-3,5-diene-1-ol 86.36
C00037333 Isomenthone 86.36
C00048312 alpha-Campholenal
(+)-alpha-Campholenal		 86.36
C00010999 2,4,4-Trimethyl-1-cyclohexene-1-carboxylic acid
beta-Cyclolavandulic acid		 83.33
C00011004 4,4-Dimethyl-2,5-cycloheptadienecarboxylic acid 83.33
C00000829 trans-Pinocarveol 82.61
C00003028 Borneol
(+/-)-Borneol		 82.61
C00003067 (R)-(+)-Verbenone
Verbenone		 82.61
C00010291 (2E,6S)-Dimethyl-2,7-octadiene-1,6-diol 82.61
C00010297 3,7-Dimethyl-2,7-octadiene-1,6-diol 82.61
C00011022 (-)-Isoborneol
L-Isoborneol
(-)-Isoborneol		 82.61
C00011023 (+)-Borneol 82.61
C00011031 (-)-Pinocampheol 82.61
C00011040 trans-(-)-Pinocarveol
L-trans-pinocarveol
L-trans-Pinocarveol		 82.61
C00011059 Nojigiku alcohol
(1S-exo)-,5-dimethyl-6-methylenebicyclo[2.2.1]heptan-2-ol		 82.61
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