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


and

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




INPUT WORD = C00010427 , 50% or more
[ Metabolite Name : (2S,4R,6S)-6-Bromo-1,4-epoxy-3(8)-ochtoden-2-ol , (3alpha,6alpha,7abeta)-(-)-6-bromo-2,3,5,6,7,7a-hexahydro-5,5-dimethyl-3-benzofuranol ]
Number of matched data : 116

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010426 (2R,4R,6S)-6-Bromo-1,4-epoxy-3(8)-ochtoden-2-ol
(3alpha,6beta,7aalpha)-(-)-6-bromo-2,3,5,6,7,7a-hexahydro-5,5-dimethyl-3-benzofuranol		 100.00
C00010446 Ochtodiol 92.86
C00010435 1,6-Dibromo-2-chloro-3(8)-ochtoden-4-ol
5-Bromo-2-(2-bromo-1-chloroethl)-4,4-dimethyl-2-cyclohexen-1-ol		 89.29
C00010425 (4R,6S,8S)-6-Bromo-1,4-epoxy-2-ochtoden-8-ol
(4alpha,6beta,7aalpha)-(+)-6-bromo-2,4,5,6,7,7a-hexahydro-5,5-dimethyl-4-benzofuranol		 88.89
C00010439 (1E,4R,6S)-1,6-Dibromo-1,3(8)-ochtodien-4-ol
[1alpha,2(E),5alpha]-(-)-5-bromo-2-(2-bromoethenyl)-4,4-dimethyl-2-cyclohexen-1-ol		 88.89
C00010440 (1E,4S,6S)-1,6-Dibromo-1,3(8)-ochtodien-4-ol
[1alpha,2(E),5beta]-(-)-5-bromo-2-(2-bromoethenyl)-4,4-dimethyl-2-cyclohexen-1-ol		 88.89
C00010431 2-Chloro-1,6,8-tribromo-3(8)-ochtodene 85.71
C00010432 Chondrocole A 85.19
C00010434 Chondrocole C 85.19
C00010829 1,4-Epoxy-p-menthane-2,3-diol
Ascaridole glycol		 85.19
C00010987 Filifolide A 85.19
C00010393 7-Bromo-4,6,8-trichloro-2,6-dimethyl-1,4-octadien-3-one 82.76
C00001329 gamma-Undecalactone 81.48
C00003030 Carvone oxide 81.48
C00003042 Diosphenol
Buccocamphor		 81.48
C00010394 Cartilagineal 81.48
C00010459 Plocamadiene A
2-Bromo-1-chloro-4-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 81.48
C00010840 trans-Carvone oxide
1,6-Epoxy-p-menth-8-en-2-one		 81.48
C00010920 (1R,2R,4S)-p-Menth-5-ene-1,2-diol 81.48
C00010921 [1S-(1alpha,2alpha,5alpha)]-2-Methyl-5-(1-methylethyl)-3-cyclohexene-1,2-diol 81.48
C00010922 [1R-(1alpha,2alpha,5beta)]-2-Methyl-5-(1-methylethyl)-3-cyclohexene-1,2-diol 81.48
C00010923 [1S-(1alpha,2beta,5alpha)]-2-Methyl-5-(1-methylethyl)-3-cyclohexene-1,2-diol 81.48
C00011007 5,5-Dimethyl-1,3,6-cycloheptatriene-1-carboxylic acid 81.48
C00011030 4-Hydroxy-4,6,6-trimethylbicyclo[3.1.1]heptan-2-one 81.48
C00011495 Nordavanone 81.48
C00036344 (3E)-3,7-Dimethyl-3-octene-1,2,6,7-tetrol
(-)-(3E)-3,7-Dimethyl-3-octene-1,2,6,7-tetrol		 81.48
C00036362 1,1,5-Trimethyl-2-formyl-4-methoxy-[2,5]-cyclohexadiene 81.48
C00041772 Platydiol 81.48
C00043414 Crocusatin K
(+)-Crocusatin K		 81.48
C00043415 Crocusatin L
(+)-Crocusatin L		 81.48
C00049396 Sapinofuranone A 81.48
C00049397 Sapinofuranone B 81.48
C00010433 Chondrocolactone 79.31
C00032377 trans-Pinocarvyl acetate 79.31
C00042866 Propanoic acid 2-methyl-3-hydroxy-2,4,4-trimethylpentyl ester 79.31
C00010436 1,6-Dibromo-8-chloro-2-ochtoden-4-ol 78.57
C00010451 2,4-Dibromo-1-chloro-5-(2-chloroethyenyl)-1,5-dimethylcyclohexane 78.57
C00010460 4-Bromo-1,5-dichloro-2-chloroethenyl-1,5-dimethylcyclohexane 78.57
C00010461 1,4-Dibromo-5-chloro-2-(2-chloroethenyl)-1,5-dimethylcyclohexane 78.57
C00010966 [1R-(1alpha,2beta,3alpha,4alpha)]-6-(hydroxymethyl)-3-(1-methylethyl)-5-Cyclohexene-1,2,4-triol 78.57
C00035825 Dihydrocarveol acetate
Dihydrocarveyl acetate
Dihydrocarvyl acetate		 78.57
C00040381 Stagonolide G
(+)-Stagonolide G		 78.57
C00048350 Carvyl acetate 78.57
C00000319 Dihydroactinidiolide 77.78
C00000838 3,4-Menthone lactone 77.78
C00001422 Muscarine 77.78
C00001984 Tecostanin 77.78
C00002273 Anatoxin alpha
Anatoxin-a		 77.78
C00002291 Ecgonine 77.78
C00003027 Ascaridole 77.78
C00003086 Iridomyrmecin 77.78
C00007508 4-Maleyl-acetoacetic acid
2-Octenedioic acid		 77.78
C00007654 2-Oxo-9-methylthiononanoic acid
9-Methylthio-2-nonanoic acid		 77.78
C00010310 2,6-Dimethyl-7-octene-2,3,6-triol 77.78
C00010314 (+)-Eldanolide
2(3H)-Furanone		 77.78
C00010335 Linalyl oxide
2,6-Dimethyl-3,6-oxido-7-octen-2-ol		 77.78
C00010343 2-(4-Methyl-3-pentenyl)-2-butene-1,4-diol
alpha-(Z)-Acaridiol		 77.78
C00010358 4-Ethenyl-3-hydroxy-2-hydroxymethyl-2,5,5-trimethyltetrahydrofuran 77.78
C00010378 6-Bromo-3-bromomethyl-3,7-dichloro-7-methyl-1-octene 77.78
C00010386 1-(3,3-Dimethyloxiranyl)-2,2-dimethyl-3-buten-1-one-epoxyartemisia ketone 77.78
C00010396 (Z)-(-)-8-Chloro-6-chloromethyl-2-methyl-1,6-octadien-3-ol 77.78
C00010408 4,8-Dibromo-3,7-dichloro-3,7-dimethyl-1,5-octadiene 77.78
C00010455 Plocamene D'
4-Bromo-2-chloro-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 77.78
C00010464 Plocamene E 77.78
C00010716 (+)-Teucriumlactone
Allodolicholactone
Teucriumlactone		 77.78
C00010806 Eucommiol 77.78
C00010819 1-Methyl-4-(1-methylethenyl)-2,3-dioxabicyclo[2.2.2]oct-5-ene
1,4-Epidioxy-p-mentha-2,8-diene		 77.78
C00010826 1,4-Epoxy-p-menthan-2-ol 77.78
C00010851 Pseudodiosphenol 77.78
C00010897 [1S-(1a,2a,4b)]-1-methyl-4-(1-methylethyl)-1,2,4-Cyclohexanetriol 77.78
C00010918 (1R-trans)-1-Methyl-4-(1-methylethyl)-4-cyclohexene-1,2-diol 77.78
C00010924 8,9-p-Menthen-1,2-diol
8-p-Menthene-1,2-diol
Limonene glycol
d-Limonene-1,2-diol
p-Menth-8-ene-1,2-diol		 77.78
C00010952 (4R-cis)-3-Methylene-6-(1-methylethyl)-4-nitrocyclohexene 77.78
C00010953 (4S-trans)-3-Methylene-6-(1-methylethyl)-4-nitrocyclohexene 77.78
C00010981 Ferulol 77.78
C00011004 4,4-Dimethyl-2,5-cycloheptadienecarboxylic acid 77.78
C00011005 4,4-Dimethyl-2,6-cycloheptadienecarboxylic acid 77.78
C00011015 Angelicoidenol 77.78
C00011019 [1S-(endo,endo)]-1-(Hydroxymethyl)-7,7-dimethyl-bicyclo[2.2.1]heptane-2,3-diol 77.78
C00011020 [1S-(2-endo,3-exo)]-1-(hydroxymethyl)-7,7-dimethyl-bicyclo[2.2.1]heptane-2,3-diol 77.78
C00011021 (1R-endo)-3-hydroxy-4-(hydroxymethyl)-7,7-dimethyl-bicyclo[2.2.1]heptan-2-one 77.78
C00011051 trans-(-)-2-Acetyl-1-isopropylcyclopropaneacetic acid 77.78
C00011950 5-(1-Methylethyl)-2-propyl-2-cyclohexen-1-one 77.78
C00012026 Geijeron
Geijerone		 77.78
C00013224 (-)-Geosmin
Geosmin
[4S-(4alpha,4aalpha,8abeta)]-Octahydro-4,8a-dimethyl-4a(2H)-naphthalenol		 77.78
C00017114 (+)-Streptenol A
IC 201
Streptenol A		 77.78
C00017115 Streptenol B 77.78
C00017116 Streptenol C 77.78
C00017117 Streptenol D 77.78
C00017463 (+)-(1S,10R)-1,10-Dimethylbicyclo[4.4.0]dec-6-en-3-one 77.78
C00018197 Enaminomycin C 77.78
C00023988 3,5-Dihydroxydecanoic acid delta-lactone 77.78
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		 77.78
C00025556 3beta-Acetoxytropane
O-Acetylpseudotropine		 77.78
C00027602 (-)-allo-Muscarine 77.78
C00029347 (Z)-3-Hexenyl 3-methylbutanoate
(Z)-3-Hexenyl isovalerate		 77.78
C00030981 Phellodendric acid A
(+)-Phellodendric acid A		 77.78
C00031464 (4R)-4-Hydroxymethylboschnialactone 77.78
C00032860 Crocusatin B
(+)-Crocusatin B		 77.78
C00032862 Crocusatin D
(-)-Crocusatin D		 77.78
C00034590 Lyratyl acetate 77.78
C00035190 1,3R,8R-Trihydroxydec-9-en-4,6-yne 77.78
C00035548 Butyl caprylate 77.78
C00036900 Chrysanthemyl acetate 77.78
C00037283 Hyacinthacine A3
(1R,2R,3R,5R,7aR)-1,2-Dihydroxy-3-hydroxymethyl-5-methylpyrrolizidine		 77.78
C00041256 1S,2S,4R-Limonene-1,2-diol
(+)-1S,2S,4R-Limonene-1,2-diol		 77.78
C00043413 Crocusatin J
(+)-Crocusatin J		 77.78
C00044935 Modiolide B 77.78
C00046016 Hyacinthacine A4
(-)-Hyacinthacine A4		 77.78
C00046017 Hyacinthacine A5
(-)-Hyacinthacine A5		 77.78
C00046018 Hyacinthacine A6
(+)-Hyacinthacine A6		 77.78
C00046019 Hyacinthacine A7
(-)-Hyacinthacine A7		 77.78
C00046162 MKN-004B
(-)-MKN-004B		 77.78
C00046163 MKN-004C
(+)-MKN-004C		 77.78
C00046164 MKN-004D
(-)-MKN-004D		 77.78
C00049081 3,7-Dimethyl-5-hydroxyoct-1-en-6-one
(+)-3,7-Dimethyl-5-hydroxyoct-1-en-6-one		 77.78
Page Top