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


and

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




INPUT WORD = C00036279 , 50% or more
[ Metabolite Name : (-)-Hepta-4,6-diyne-2,3-diol , (-)-4,6-Heptadiyne-2,3-diol ]
Number of matched data : 81

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00048033 Osmundalactone
(-)-Osmundalactone		 88.89
C00000395 1,5Z-Octadien-3R-ol 88.24
C00000397 1,5Z-Octadien-3S-ol 88.24
C00019677 4-Methyl-2-oxopentanoic acid
2-Oxoisocaproate		 88.24
C00035116 3-Methyl butyl acetate
Isoamyl acetate
3-Methylbutyl acetate		 88.24
C00042802 Ophiocerin A
(-)-Ophiocerin A		 83.33
C00042803 Ophiocerin B
(-)-Ophiocerin B		 83.33
C00042804 Ophiocerin C
(+)-Ophiocerin C		 83.33
C00047172 Ampelomin A
(+)-Ampelomin A		 83.33
C00000303 Parasorbic acid 82.35
C00001254 2-Heptanone
Heptan-2-one
Methyl-n-pentyl ketone		 82.35
C00001264 1-Octanol
Octan-1-ol
Octanol
n-Octanol		 82.35
C00001310 Ethyl 2-methylbut-2-enoate
Ethyl tiglate		 82.35
C00001377 L-Leucine
L-Leu		 82.35
C00007474 2-Oxo-4-(methylthio)butanoic acid
4-(Methylthio)-2-oxobutanoic acid		 82.35
C00016488 Armentomycin
L-Armentomycin		 82.35
C00018307 gamma-Chloronorvaline
Antibiotic AL 719		 82.35
C00019658 2-Acetolactate 82.35
C00030220 Ethyl-2-methylbutanoate
Ethyl 2-methyl butyrate
ethyl 2-methyl butyrate
Ethyl 2-methylbutanoate		 82.35
C00034765 3-Octanone
Octan-3-one		 82.35
C00035483 2-Methyl butyl acetate
2-Methylbutyl acetate		 82.35
C00048247 (S)-2-Heptanol 82.35
C00032853 Conduritol F 80.00
C00047174 Ampelomin C
(-)-Ampelomin C		 80.00
C00047175 Ampelomin D
(-)-Ampelomin D		 80.00
C00047176 Ampelomin E
(-)-Ampelomin E		 80.00
C00047177 Ampelomin F
(+)-Ampelomin F		 80.00
C00048929 (-)-Conduritol F
Leucanthemitol		 80.00
C00048968 Conduritol A 80.00
C00033589 7-Octene-1,6-diol 78.95
C00035612 Ethyl hexanoate
Ethyl caproate		 78.95
C00035701 1-Hexyl acetate
n-Hexyl acetate
Hexyl acetate		 78.95
C00035766 (E)-2-Hexenyl acetate
trans-2-Hexenyl acetate		 78.95
C00000210 CID is old! 77.78
C00000334 Cyclohexylcarboxylic acid
Hexahydrobenzoic acid		 77.78
C00001115 Deoxyribose
2-Deoxy-D-arabinose
Thyminose
2-Deoxy-D-erythro-pentose		 77.78
C00001381 alpha-(Methylenecyclopropyl)glycine 77.78
C00001387 L-Pipecolic acid
Pipecolic acid		 77.78
C00010859 Isopropylcyclohexane 77.78
C00028721 Norhygrine
N-Demethylhygrine		 77.78
C00036613 6-Deoxy-fagomine
(-)-6-Deoxy-fagomine		 77.78
C00041442 cis-2-Hydroxymethyl-3-methylcyclopentanone 77.78
C00042856 Pipecolamide 77.78
C00000241 Fucoserratene
(3E,5Z)-1,3,5-Octatriene		 76.47
C00000318 Caprolactam 76.47
C00000352 (E)-3-Hexenal 76.47
C00000353 cis-3-Hexenal
(Z)-3-Hexenal
(Z)-Hex-3-enal		 76.47
C00000356 cis-3-Hexen-1-ol
(Z)-3-hexen-1-ol
(3Z)-3-Hexen-1-ol
cis-3-Hexenol
(Z)-3-Hexenol		 76.47
C00001192 L-(-)-Malic acid
L-Malic acid		 76.47
C00001218 Caproic acid
1-Hexanoic acid
Hexanoic acid
n-Hexanoic acid		 76.47
C00001374 L-isoleucine 76.47
C00001379 L-Methionine
Methionine		 76.47
C00001384 L-Ornithine
L-Orn
Ornithine		 76.47
C00007378 5-Aminolevulinic acid 76.47
C00007475 L-Glutamate 5-semialdehyde 76.47
C00007623 Ketovaline
2-Ketoisovalerate
alpha-Ketoisovalerate
3-Methyl-2-oxobutanoic acid		 76.47
C00007667 5-Methylsufinylpentyl nitrile 76.47
C00011400 6-Methyl-5-hepten-2-one 76.47
C00018095 1-Deoxy-D-threo-pentulose
1-Deoxy-D-xylulose
D-1-Deoxyxylulose		 76.47
C00018286 Scorodonin 76.47
C00018833 Ro 07-7957
trans-L-2-Amino-4-methoxy-3-butenoic acid		 76.47
C00019678 2,3-Dihydroxy-isovaleric acid
2,3-Dihydroxyisovaleric acid		 76.47
C00029316 (2E)-Octenal
trans-Oct-2-en-1-al
(E)-2-Octenal
trans-2-Octenal		 76.47
C00029423 1-Octen-3-ol
Oct-1-en-3-ol		 76.47
C00029580 6-Methyl-5-hepten-2-ol
Sulcatol		 76.47
C00030880 Octanal
n-Octanal		 76.47
C00032250 Succinic acid methyl ester
Butanedioic acid 1-methyl ester		 76.47
C00034761 2E,4Z-Octadienal 76.47
C00034775 6-Methyl-5-hepten-2-one
6-Methylhept-5-en-2-one		 76.47
C00034880 Heptanal
n-Heptanal		 76.47
C00034882 Nonane
n-Nonane		 76.47
C00035495 3-Octanol
Octan-3-ol		 76.47
C00035700 n-Heptanol 76.47
C00035797 6-Methyl-1-heptene 76.47
C00035881 trans-2,4-hexadienal 76.47
C00035904 2-C-Methyl-D-erythritol 76.47
C00035928 3,5-Nonadiyne 76.47
C00036427 1-Deoxy-D-ribitol 76.47
C00038105 (S)-cis-Amino-5-chloro-4-pentenoic acid
(Z)-2-Amino-5-chloro-4-pentenoic acid		 76.47
C00048943 3,4-Dimethyl heptane 76.47
C00048958 Butyl acetate 76.47
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