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


and

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




INPUT WORD = C00011037 , 50% or more
[ Metabolite Name : trans-Chrysanthenyl acetate ]
Number of matched data : 70

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011039 (1alpha,5alpha,6alpha)-(-)-2,6-dimethylbicyclo[3.1.1]hept-2-ene-6-methanol acetate 96.55
C00048350 Carvyl acetate 93.10
C00003153 cis-alpha-Irone 90.00
C00003154 trans-alpha-Irone 90.00
C00043138 (6R,9R)-9-Hydroxy-4-megastigmen-3-one 90.00
C00048295 7,8-Dihydro-alpha-ionone
(-)-7,8-Dihydro-alpha-ionone		 90.00
C00000850 Menthyl acetate 89.66
C00010977 Carquejol acetate 89.66
C00011895 Norbisabolide
(R*,R*)-(+)-Dihydro-5-methyl-5-(4-methyl-3-cyclohexen-1-yl)-2(3H)-furanone		 89.66
C00032377 trans-Pinocarvyl acetate 89.66
C00035674 Lavandulyl acetate
(-)-Lavandulyl acetate		 89.66
C00036314 (+)-Menthyl acetate 89.66
C00011035 6-Acetoxy-trans-pinocarveol 87.10
C00029668 alpha-Cyclogeraniol acetate 86.67
C00043180 3,9-Dihydroxy-4-megastigmene 86.67
C00000842 (+)-Bornyl acetate
Bornyl acetate		 86.21
C00010367 5-Methyl-2-(1-methylethenyl)-3-hexene-1,5-diol 86.21
C00010469 trans-Acetate-1-methyl-2-(1-methylethenyl)-cyclobutaneethanol 86.21
C00021957 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-ol 86.21
C00029816 beta-Ionone
(E)-beta-Ionone
beta-lonone
trans-beta-ionone		 86.21
C00035043 alpha-terpineol acetate
Terpinyl acetate
alpha-Terpinyl acetate		 86.21
C00035586 Dihydroedulan I 86.21
C00035825 Dihydrocarveol acetate
Dihydrocarveyl acetate
Dihydrocarvyl acetate		 86.21
C00039214 Ficusic acid 86.21
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene		 84.38
C00003203 alpha-Ylangene 84.38
C00021865 Copadiene 84.38
C00029298 (+)-Dehydrovomifoliol
Dehydrovomifoliol
S-(+)-Dehydrovomifoliol		 84.38
C00029834 (+)-Blumenol A
Blumenol A
Roseoside aglycon
Vomifoliol
(+)-Vomifoliol		 84.38
C00042289 Blumenol B 84.38
C00044031 (+)-alpha-Copaene 84.38
C00012709 (-)-alpha-Helmiscapene
alpha-Helmiscapene
[2S-(2a,4ab,8ab)]-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene		 83.87
C00012710 5beta,10alpha-Eudesma-3,11-diene 83.87
C00012711 [2R-(2alpha,4aalpha,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene 83.87
C00029672 (-)-alpha-Selinene
alpha-Selinene		 83.87
C00030189 epi-alpha-Selinene 83.87
C00035675 Lavandulyl isobutyrate 83.87
C00036276 (-)-Eudesma-2,4(15)-11-triene 83.87
C00036298 (+)-alpha-Selinene 83.87
C00036373 1,2-Epoxymenthyl acetate 83.87
C00048297 7-epi-alpha-Selinene 83.87
C00010818 cis-(+)-2-(Ethoxymethyl)-4-hydroxy-5-(1-methylethyl)-2-cyclohexen 83.33
C00010847 (2S-cis)-5-(Acetyloxy)-5-methyl-2-(1-methylethyl)-cyclohexanone
1-Acetoxy-p-menthan-3-one		 83.33
C00022191 Apo-9-zeaxanthinone 83.33
C00029325 (3S,5R,6S,9R)-Megastigman-3,9-diol 83.33
C00034305 Tectoionol B 83.33
C00034801 beta-Irone 83.33
C00003065 Thymol acetate
Thymyl acetate		 82.76
C00010295 3,7-Dimethyl-2,5-octadiene-1,7-diol 82.76
C00010391 8-Bromo-1,3,4,7-tetrachloro-3,7-dimethyl-1,5-octadiene 82.76
C00010462 Plocamene B 82.76
C00010952 (4R-cis)-3-Methylene-6-(1-methylethyl)-4-nitrocyclohexene 82.76
C00010953 (4S-trans)-3-Methylene-6-(1-methylethyl)-4-nitrocyclohexene 82.76
C00011042 (1S,5R)-(+)-6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid 82.76
C00020990 Clavularin A 82.76
C00021958 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien 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
C00030882 2-Octyl 3-methyl butyrate
Octyl isovalerate		 82.76
C00035029 7-Hydroxymyrtenal
(-)-7-Hydroxymyrtenal		 82.76
C00035030 7-Hydroxymyrtenol
(+)-7-Hydroxymyrtenol		 82.76
C00035258 cis-Sabinene hydrate acetate 82.76
C00035536 beta-Damascenone
(E)-beta-Damascenone		 82.76
C00035538 beta-Isocyclolavandulyl acetate 82.76
C00035564 Citronellyl acetate
Citronellol acetate		 82.76
C00045569 4,9-Dimethyldecanoic acid 82.76
C00045805 Crocusatin G
(+)-Crocusatin G		 82.76
C00049012 Schiffnerone B
(+)-Schiffnerone B		 82.76
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