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


and

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




INPUT WORD = C00003036 , 50% or more
[ Metabolite Name : cis-Citral , (Z)-Citral , beta-Citral , Neral , Citral Z ]
Number of matched data : 75

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00000845 (E)-geraniol
Geraniol
trans-Geraniol		 100.00
C00003035 trans-Citral
(E)-Citral
(E)-alpha-Citral
Geranial		 100.00
C00035822 Citral
Citral (E/Z)		 100.00
C00000844 Citronellol 95.24
C00000855 beta-Nerol
Nerol
cis-Geraniol
(Z)-Geraniol		 95.24
C00003037 (R)-Citronellal
(R)-3,7-Dimethyl-6-octenal		 95.24
C00003038 (+)-Citronellol
(+)-R-Citronellol
(R)-beta-Citronellol
(R)-3,7-Dimethyl-6-octen-1-ol		 95.24
C00010309 (-)-S-Citronellal
(S)-3,7-Dimethyl-6-octenal		 95.24
C00011383 DMNT
(E)-4,8-Dimethyl-1,3,7-nonatriene		 95.24
C00035823 Citronellal 95.24
C00010296 3,7-Dimethyl-2,6-octadiene-1,4-diol 91.30
C00010343 2-(4-Methyl-3-pentenyl)-2-butene-1,4-diol
alpha-(Z)-Acaridiol		 91.30
C00000815 (-)-trans-Isopiperitenol 90.91
C00000827 Pulegone
(+)-Pulegone
(+)-(R)-Pulegone		 90.91
C00010889 Piperitenone
p-Mentha-1,4(8)-dien-3-one
Pulespenone
3-Terpinolenone		 90.91
C00010936 p-Menth-4(8)-en-3-ol
(-)-cis-Pulegol		 90.91
C00010946 S-(-)-Pulegone 90.91
C00003047 (+-)-Linalool
linalool
Linalool
beta-Linalool
(R)-linalool
(R)-(-)-3,7-Dimethyl-1,6-octadien-3-ol		 90.48
C00010301 (+)-S-Linalool
S-(+)-Linalool
(S)-Linalool
Coriandrol
(S)-3,7-Dimethyl-1,6-octadien-3-ol		 90.48
C00010338 7-Methyl-3-methylene-1-octanol
Bupleurol		 90.48
C00029330 (E)-2-Decenal
trans-2-Decenal		 90.48
C00029453 2-Decanol
2-Hydroxydecane		 90.48
C00034575 Lavandulol 90.48
C00034888 (-)-linalool
(-)-R-Linalool
-(-)-Linalool		 90.48
C00048310 2,6-Dimethyl-2,4,6-octatriene
Allo-Ocimene
Alloocimene		 90.48
C00048486 Neo-allo-ocimene
Neoalloocimene		 90.48
C00000863 R-(+)-trans-Verbenol 86.96
C00010297 3,7-Dimethyl-2,7-octadiene-1,6-diol 86.96
C00010311 (S)-3,7-Dimethyl-6-octenoic acid
(S)-Citronellic acid		 86.96
C00010395 1-Chloro-3-chloromethyl-7-methyl-2,6-octadiene 86.96
C00029977 cis-Verbenol 86.96
C00031259 Sachalol 86.96
C00000809 (-)-Isopiperitenone 86.36
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
C00003054 Piperitone
p-Menth-1-en-3-one
(+)-Piperitone		 86.36
C00010336 Rosefuran
3-Methyl-2-(3-methyl-2-butenyl)furan		 86.36
C00010344 Perillene
3-(4-Methyl-3-pentenyl)furan		 86.36
C00010466 Chrysanthemol
Chrysanthemyl alcohol		 86.36
C00010467 Grandisol 86.36
C00010468 Fragranol 86.36
C00010470 Junionone 86.36
C00010879 (+)-cis-p-Mentha-1(7),8-dien-2-ol 86.36
C00010880 (+)-trans-p-Mentha-1(7),8-dien-2-ol 86.36
C00010881 trans-p-Mentha-1(7),8-dien-3-ol 86.36
C00010890 (+)-Isopiperitenone
p-Mentha-1,8-dien-3-one		 86.36
C00010901 (-)-Carvomenthone 86.36
C00010902 (+)-Isomenthone 86.36
C00010903 (+)-Menthone 86.36
C00010904 (-)-Isomenthone 86.36
C00010911 (S)-(-)-Phellandral 86.36
C00010925 (3S,4S)-(-)-p-Menth-1-en-3-ol
trans-(-)-Piperitol		 86.36
C00010926 (3R,4R)-Piperitol
(+)-trans-Piperitol		 86.36
C00010935 gamma-Terpineol
p-Menth-4(8)-en-1-ol		 86.36
C00010937 Dihydrocarveol
p-Menth-8-en-2-ol		 86.36
C00010938 Isopulegol
(-)-Isopulegol		 86.36
C00010939 (+)-Neoisopulegol 86.36
C00010941 (-)-Piperitone 86.36
C00010942 (+-)-p-Menth-6-en-3-one 86.36
C00010947 (1S,4R)-(+)-Isodihydrocarvone 86.36
C00010948 (+)-Isopulegone
(2R-trans)-5-methyl-2-(1-methylethenyl)-cyclohexanone		 86.36
C00030810 Neodihydrocarveol 86.36
C00033439 trans-Dihydrocarvone 86.36
C00034465 cis-Chrysanthemol
cis-Chrysanthemyl alcohol		 86.36
C00034726 trans-Chrysanthemyl alcohol 86.36
C00035118 Isomenthol 86.36
C00035341 Menthone 86.36
C00035737 Safranal 86.36
C00037051 Dihydrocarvone
(E)-Dihydrocarvone		 86.36
C00037333 Isomenthone 86.36
C00042278 beta-Cyclocitral 86.36
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