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


and

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




INPUT WORD = C00010286 , 50% or more
[ Metabolite Name : 1-Acetoxy-7-hydroxy-3,7-dimethyl-2E,5E-octadien-4-one ]
Number of matched data : 73

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00022691 9-Peroxy-5,6E-dehydro-6,7-dihydrogeranyl acetate 96.77
C00010295 3,7-Dimethyl-2,5-octadiene-1,7-diol 93.55
C00022686 6-Peroxy-7(9)-dehydro-6,7-dihydrogeranyl acetate 93.55
C00010288 1-Acetoxy-7-hydroperoxy-3,7-dimethyl-2E,5E-octadien-4-one 90.91
C00011035 6-Acetoxy-trans-pinocarveol 90.32
C00022662 (E)-7-Hydroperoxy-3,7-dimethyl-, 3-acetate 1,5-octadien-3-ol 90.32
C00022688 6-Peroxy-7(9)-dehydro-2,3,6,7-tetrahydrogeranyl acetate 90.32
C00012465 (E,E)-2,9,9-Trimethyl-6-methylene-2,7-cycloundecadien-1-one
gamma-Humulen-9-one		 87.50
C00032567 (1R,4S)-1-Hydroperoxy-p-menth-2-en-8-ol acetate 87.50
C00040375 Stagonolide 87.50
C00010367 5-Methyl-2-(1-methylethenyl)-3-hexene-1,5-diol 87.10
C00010818 cis-(+)-2-(Ethoxymethyl)-4-hydroxy-5-(1-methylethyl)-2-cyclohexen 87.10
C00012423 (-)-Noranthoplone
Noranthoplone		 87.10
C00012470 (E,E)-4,4,8-Trimethyl-2,8-cycloundecadien-1-one
Rudbeckianone		 87.10
C00017770 (R)-(+)-Patulolide B
Patulolide B		 87.10
C00017771 (+)-Patulolide C
Patulolide C		 87.10
C00022685 6-Hydroxy-7(9)-dehydro-6,7-dihydrogeranyl acetate 87.10
C00022687 6-Oxo-7(9)-dehydro-6,7-dihydrogeranyl acetate 87.10
C00022690 6-Peroxy-7(9)-dehydro-6,7-dihydroneryl acetate 87.10
C00036373 1,2-Epoxymenthyl acetate 87.10
C00046160 MKN-003B 87.10
C00011426 2,6,10-Trimethyl-3,6,11-dodecatriene-2,10-diol 84.85
C00012488 Buddledin C 84.85
C00012489 Buddledin D 84.85
C00000233 12-Hydroxyjasmonic acid 84.38
C00011559 beta-Monocyclonerolidol 84.38
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 84.38
C00012467 Zerumbone 84.38
C00015965 Cladospolide D 84.38
C00031308 Sarmentol A
(-)-Sarmentol A		 84.38
C00031309 Sarmentol B
(+)-Sarmentol B
9-epi-Sarmentol A		 84.38
C00031310 Sarmentol D 84.38
C00031770 Erigerenone A 84.38
C00041431 Chloriolide
(+)-Chloriolide		 84.38
C00042295 Boscialin 84.38
C00042630 iso-Cladospolide B
(-)-iso-Cladospolide B		 84.38
C00045783 Cladospolide B
(+)-Cladospolide B		 84.38
C00000850 Menthyl acetate 83.87
C00003046 Geranyl acetate
Acetic acid geraniol ester
trans-Geranyl acetate		 83.87
C00003110 beta-Caryophyllene
(E)-beta-Caryophyllene
caryophyllene
Caryophyllene
(E)-Caryophyllene
(-)-(E)-Caryophyllene
trans-Caryophyllene
trans-beta-Caryophyllene		 83.87
C00010326 3-Acetoxy-2,2,6-trimethyl-6-vinyltetrahydropyran
2,2,6-Trimethyl-2-vinyl-5-acetoxytetrahydropyran		 83.87
C00010469 trans-Acetate-1-methyl-2-(1-methylethenyl)-cyclobutaneethanol 83.87
C00010632 1S-Acetoxy-3-myodesertene 83.87
C00010754 (+)-Gentiolactone
Gentiolactone		 83.87
C00010847 (2S-cis)-5-(Acetyloxy)-5-methyl-2-(1-methylethyl)-cyclohexanone
1-Acetoxy-p-menthan-3-one		 83.87
C00011014 Vulgarole 83.87
C00011374 Crocinervolide 83.87
C00011444 Deisopropylngaione 83.87
C00012454 gamma-Humulene
Isohumulene		 83.87
C00012471 (+)-9-epi-beta-Caryophyllene
9-epi-(E)-Caryophyllene		 83.87
C00012474 Isocaryophyllene
(-)-Isocaryophyllene
(Z)-Caryophyllene
gamma-Caryophyllen
cis-Caryophyllene		 83.87
C00016880 Decarestrictin N
Decarestrictine N		 83.87
C00020052 gamma1-Cadinene 83.87
C00022191 Apo-9-zeaxanthinone 83.87
C00029056 Streptenol E 83.87
C00029325 (3S,5R,6S,9R)-Megastigman-3,9-diol 83.87
C00032377 trans-Pinocarvyl acetate 83.87
C00035138 Neryl acetate 83.87
C00035538 beta-Isocyclolavandulyl acetate 83.87
C00035825 Dihydrocarveol acetate
Dihydrocarveyl acetate
Dihydrocarvyl acetate		 83.87
C00036314 (+)-Menthyl acetate 83.87
C00037964 Tschimganical A
(+)-Tschimganical A		 83.87
C00038624 Botryolide D
(-)-Botryolide D		 83.87
C00038955 Decarestrictine D
(-)-Decarestrictine D		 83.87
C00039251 Gallicynoic acid G
(-)-Gallicynoic acid G		 83.87
C00039778 Modiolide A
(+)-Modiolide A		 83.87
C00039801 Multiplolide A
(+)-Multiplolide A		 83.87
C00040377 Stagonolide C
(+)-Stagonolide C		 83.87
C00040378 Stagonolide D
(-)-Stagonolide D		 83.87
C00040382 Stagonolide H
(-)-Stagonolide H		 83.87
C00044032 (+)-beta-Caryophyllene 83.87
C00048670 Curvulide B1 83.87
C00048671 Curvulide B2 83.87
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