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


and

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




INPUT WORD = C00035538 , 50% or more
[ Metabolite Name : beta-Isocyclolavandulyl acetate ]
Number of matched data : 76

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035541 beta-Isocyclolavandulyl propionate 93.33
C00000850 Menthyl acetate 92.86
C00010469 trans-Acetate-1-methyl-2-(1-methylethenyl)-cyclobutaneethanol 92.86
C00036314 (+)-Menthyl acetate 92.86
C00010367 5-Methyl-2-(1-methylethenyl)-3-hexene-1,5-diol 89.66
C00021957 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-ol 89.66
C00035674 Lavandulyl acetate
(-)-Lavandulyl acetate		 89.29
C00035825 Dihydrocarveol acetate
Dihydrocarveyl acetate
Dihydrocarvyl acetate		 89.29
C00035539 beta-Isocyclolavandulyl isobutyrate 87.50
C00021958 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien 86.21
C00032377 trans-Pinocarvyl acetate 86.21
C00035258 cis-Sabinene hydrate acetate 86.21
C00035586 Dihydroedulan I 86.21
C00010453 Mertensene 85.71
C00010530 cis-Tachlorin
(+)-Cistachlorin
Cistachlorin		 85.71
C00035138 Neryl acetate 85.71
C00035459 11-Methyl-4-dodecanone 85.71
C00035536 beta-Damascenone
(E)-beta-Damascenone		 85.71
C00035548 Butyl caprylate 85.71
C00035564 Citronellyl acetate
Citronellol acetate		 85.71
C00035611 Ethyl decanoate
Ethyl caprate		 85.71
C00036900 Chrysanthemyl acetate 85.71
C00045569 4,9-Dimethyldecanoic acid 85.71
C00010286 1-Acetoxy-7-hydroxy-3,7-dimethyl-2E,5E-octadien-4-one 83.87
C00011035 6-Acetoxy-trans-pinocarveol 83.87
C00021959 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-diene-7,8-diol 83.87
C00003153 cis-alpha-Irone 83.33
C00003154 trans-alpha-Irone 83.33
C00010326 3-Acetoxy-2,2,6-trimethyl-6-vinyltetrahydropyran
2,2,6-Trimethyl-2-vinyl-5-acetoxytetrahydropyran		 83.33
C00010847 (2S-cis)-5-(Acetyloxy)-5-methyl-2-(1-methylethyl)-cyclohexanone
1-Acetoxy-p-menthan-3-one		 83.33
C00011374 Crocinervolide 83.33
C00029325 (3S,5R,6S,9R)-Megastigman-3,9-diol 83.33
C00043138 (6R,9R)-9-Hydroxy-4-megastigmen-3-one 83.33
C00048295 7,8-Dihydro-alpha-ionone
(-)-7,8-Dihydro-alpha-ionone		 83.33
C00010295 3,7-Dimethyl-2,5-octadiene-1,7-diol 82.76
C00011037 trans-Chrysanthenyl acetate 82.76
C00011411 2,6,10-Trimethyldodecane
Farnesane		 82.76
C00022685 6-Hydroxy-7(9)-dehydro-6,7-dihydrogeranyl acetate 82.76
C00022687 6-Oxo-7(9)-dehydro-6,7-dihydrogeranyl acetate 82.76
C00022689 6-Hydroxy-7(9)-dehydro-6,7-dihydroneryl acetate 82.76
C00029844 Borneol acetate
Bornyl acetate
Bornylacetate		 82.76
C00044936 Modiolin 82.76
C00035540 beta-Isocyclolavandulyl isovalerate 82.35
C00000319 Dihydroactinidiolide 82.14
C00001329 gamma-Undecalactone 82.14
C00001554 Tenuazonic acid 82.14
C00003046 Geranyl acetate
Acetic acid geraniol ester
trans-Geranyl acetate		 82.14
C00003048 Linalyl acetate
Linaloyl acetate		 82.14
C00003065 Thymyl acetate 82.14
C00010287 7-Hydroxyperoxy-1-hydroxy-3,7-dimethyl-2E,5E-octadien-4-one
2,3-Dioxooctyl acetate		 82.14
C00010432 Chondrocole A 82.14
C00010452 Gelidene 82.14
C00010456 Telfairine 82.14
C00010958 (-)-Menthofuran oxide
d-Menthofuranoxide		 82.14
C00010977 Carquejol acetate 82.14
C00011518 Chokol A
(-)-Chokol A		 82.14
C00011949 (+-)-5-(1-Methylethyl)-2-(2-methylpropyl)-2-cyclohexen-1-one 82.14
C00012026 Geijeron
Geijerone		 82.14
C00015664 Feigrisolide A 82.14
C00020990 Clavularin A 82.14
C00021848 Nortricycloekasantalic acid
eka-Nortricyclosantalic acid		 82.14
C00025551 3alpha-Acetoxytropane

Acetyltropine
O-Acetyltropine
Tropan-3a-ol acetate (ester)
Tropine acetate (ester)
Tropyl acetate
endo-3-Acetoxy-8-methyl-8-azabicyclo[3.2.1]octane		 82.14
C00025556 3beta-Acetoxytropane
O-Acetylpseudotropine		 82.14
C00029816 beta-Ionone
(E)-beta-Ionone
beta-lonone
trans-beta-ionone		 82.14
C00030347 gamma-Dodecalactone 82.14
C00032860 Crocusatin B
(+)-Crocusatin B		 82.14
C00034590 Lyratyl acetate 82.14
C00035043 alpha-terpineol acetate
Terpinyl acetate
alpha-Terpinyl acetate		 82.14
C00035497 4,6-Dimethylundecane 82.14
C00035563 cis-Geranyl acetone
Nerylacetone		 82.14
C00036362 1,1,5-Trimethyl-2-formyl-4-methoxy-[2,5]-cyclohexadiene 82.14
C00036363 1,1,5-Trimethyl-2-formyl-6-methoxy-[2,4]-cyclohexadiene 82.14
C00036969 Cuminyl acetate 82.14
C00040379 Stagonolide E
(-)-Stagonolide E		 82.14
C00040380 Stagonolide F
(-)-Stagonolide F		 82.14
C00045805 Crocusatin G
(+)-Crocusatin G		 82.14
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