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


and

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




INPUT WORD = C00001310 , 50% or more
[ Metabolite Name : Ethyl 2-methylbut-2-enoate , Ethyl tiglate ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00030220 Ethyl-2-methylbutanoate
Ethyl 2-methyl butyrate
ethyl 2-methyl butyrate
Ethyl 2-methylbutanoate		 94.12
C00000336 1-Cyclohexenylcarboxylic acid 88.89
C00000303 Parasorbic acid 88.24
C00035483 2-Methyl butyl acetate
2-Methylbutyl acetate		 88.24
C00000334 Cyclohexylcarboxylic acid
Hexahydrobenzoic acid		 83.33
C00001264 1-Octanol
Octan-1-ol
Octanol
n-Octanol		 82.35
C00001374 L-isoleucine 82.35
C00018286 Scorodonin 82.35
C00029316 (2E)-Octenal
trans-Oct-2-en-1-al
(E)-2-Octenal
trans-2-Octenal		 82.35
C00029580 6-Methyl-5-hepten-2-ol
Sulcatol		 82.35
C00030880 Octanal
n-Octanal		 82.35
C00034765 3-Octanone
Octan-3-one		 82.35
C00034775 6-Methyl-5-hepten-2-one
6-Methylhept-5-en-2-one		 82.35
C00035116 3-Methyl butyl acetate
Isoamyl acetate
3-Methylbutyl acetate		 82.35
C00036279 (-)-Hepta-4,6-diyne-2,3-diol
(-)-4,6-Heptadiyne-2,3-diol		 82.35
C00038105 (S)-cis-Amino-5-chloro-4-pentenoic acid
(Z)-2-Amino-5-chloro-4-pentenoic acid		 82.35
C00048943 3,4-Dimethyl heptane 82.35
C00015997 (R)-4-Ethenyltetrahydro-4-hydroxy-2H-pyran-2-one
(-)-Harzialactone B
Harzialactone B		 80.00
C00007414 2-Ethylhexanoic acid 78.95
C00007492 2-Aminomuconate semialdehyde 78.95
C00035546 Butyl butyrate 78.95
C00035612 Ethyl hexanoate
Ethyl caproate		 78.95
C00035701 1-Hexyl acetate
n-Hexyl acetate
Hexyl acetate		 78.95
C00037789 Santene 78.95
C00000210 CID is old! 77.78
C00001381 alpha-(Methylenecyclopropyl)glycine 77.78
C00017553 (-)-(1R,2S)-Cispentacin
(-)-Cispentacin
Antibiotic FR 109615
Cispentacin
FR 109615
cis-(1R,2S)-2-Aminocyclopentane-1-carboxylic acid		 77.78
C00034881 N-Methylproline
N-Methyl-L-proline
(-)-N-Methyl-L-proline		 77.78
C00042802 Ophiocerin A
(-)-Ophiocerin A		 77.78
C00042803 Ophiocerin B
(-)-Ophiocerin B		 77.78
C00042804 Ophiocerin C
(+)-Ophiocerin C		 77.78
C00047172 Ampelomin A
(+)-Ampelomin A		 77.78
C00048033 Osmundalactone
(-)-Osmundalactone		 77.78
C00000318 Caprolactam 76.47
C00001207 Tiglic acid 76.47
C00001218 Caproic acid
1-Hexanoic acid
Hexanoic acid
n-Hexanoic acid		 76.47
C00001242 Allicin 76.47
C00001254 2-Heptanone
Heptan-2-one
Methyl-n-pentyl ketone		 76.47
C00001379 L-Methionine
Methionine		 76.47
C00001384 L-Ornithine
L-Orn
Ornithine		 76.47
C00007379 L-Glutamate 1-semialdehyde 76.47
C00007475 L-Glutamate 5-semialdehyde 76.47
C00011400 6-Methyl-5-hepten-2-one 76.47
C00018833 Ro 07-7957
trans-L-2-Amino-4-methoxy-3-butenoic acid		 76.47
C00019659 (S)-4-Amino-5-oxo-pentanoic acid
Glutamic acid 1-semialdehyde		 76.47
C00029423 1-Octen-3-ol
Oct-1-en-3-ol		 76.47
C00029460 2-Methyl-2-butenoic acid 76.47
C00034761 2E,4Z-Octadienal 76.47
C00034882 Nonane
n-Nonane		 76.47
C00035495 3-Octanol
Octan-3-ol		 76.47
C00035500 4-Heptanol 76.47
C00035501 4-Heptanone 76.47
C00035857 Octane
n-Octane		 76.47
C00035928 3,5-Nonadiyne 76.47
C00036320 (+)-Tulipalin B 76.47
C00038061 (-)-Tulipalin B 76.47
C00048958 Butyl acetate 76.47
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