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


and

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




INPUT WORD = C00010816 , 50% or more
[ Metabolite Name : Dihydroxythymoquinone , DTQ , 3,6-Dihydroxy-p-mentha-3,6-diene-2,5-dione ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00048134 Speciosin A
(+)-Speciosin A		 85.71
C00010559 Gelsemiol 82.76
C00010817 1,2-Dihydroxy-p-menth-3-en-5-one 82.14
C00010918 (1R-trans)-1-Methyl-4-(1-methylethyl)-4-cyclohexene-1,2-diol 82.14
C00010962 [4S-(4alpha,5alpha,6beta)]-4,6-dihydroxy-2-(hydroxymethyl)-5-(1-methylethyl)-2-Cyclohexen-1-one 82.14
C00010966 [1R-(1alpha,2beta,3alpha,4alpha)]-6-(hydroxymethyl)-3-(1-methylethyl)-5-Cyclohexene-1,2,4-triol 82.14
C00014977 8-Chloro-9-hydroxy-8,9-deoxyasperlactone 82.14
C00032862 Crocusatin D
(-)-Crocusatin D		 82.14
C00037524 Multiflotriol 82.14
C00043190 3-Formyl-6-hydroxy-2,4,4-trimethyl-2,5-cyclohexadien-1-one
4-Hydroxy-2,6,6-trimethyl-3-oxocyclohexa-1,4-diene-1-carboxaldehyde		 82.14
C00043412 Crocusatin I 82.14
C00044520 Annularin A
(+)-Annularin A		 82.14
C00029589 7-Deoxygelsemide 80.00
C00035909 Aporpinone A
(-)-Aporpinone A		 80.00
C00010477 Alyscialactone 79.31
C00010955 (-)-Paeonilactone A
Paeonilactone-A		 79.31
C00034497 Enalin A
(-)-Enalin A		 79.31
C00036573 4-epi-Alyxialactone
(-)-4-epi-Alyxialactone		 79.31
C00045804 Crocusatin F
(-)-Crocusatin F		 79.31
C00000376 (-)-NFX 2
NFX 2		 78.57
C00010287 7-Hydroxyperoxy-1-hydroxy-3,7-dimethyl-2E,5E-octadien-4-one
2,3-Dioxooctyl acetate		 78.57
C00010429 2-Chloro-1hydroxy-3(8),5-ochtodien-4-one 78.57
C00010803 Adriadysiolide 78.57
C00010829 1,4-Epoxy-p-menthane-2,3-diol
Ascaridole glycol		 78.57
C00010841 Desacetylcalaminthone 78.57
C00010917 1-Methyl-4-(1-methylethyl)-3-cyclohexene-1,2-diol 78.57
C00011019 [1S-(endo,endo)]-1-(Hydroxymethyl)-7,7-dimethyl-bicyclo[2.2.1]heptane-2,3-diol 78.57
C00011020 [1S-(2-endo,3-exo)]-1-(hydroxymethyl)-7,7-dimethyl-bicyclo[2.2.1]heptane-2,3-diol 78.57
C00011021 (1R-endo)-3-hydroxy-4-(hydroxymethyl)-7,7-dimethyl-bicyclo[2.2.1]heptan-2-one 78.57
C00013225 (4aS-trans)-4,4a,5,6,7,8-hexahydro-4a,8-dimethyl-2(3H)-Naphthalenone
(+)-(6S,10S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one
(+)-(S,S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one		 78.57
C00015664 Feigrisolide A 78.57
C00022661 4-Hydroperoxi-4,5-dihydro-chrysanthem-5-en-ol 78.57
C00030222 Ethyl gallate
Progallin A
Ethy gallate		 78.57
C00036344 (3E)-3,7-Dimethyl-3-octene-1,2,6,7-tetrol
(-)-(3E)-3,7-Dimethyl-3-octene-1,2,6,7-tetrol		 78.57
C00037124 Ethyl beta-D-glucopyranoside
(-)-Ethyl beta-D-glucopyranoside		 78.57
C00039174 Ethyl glucopyranoside
Ethyl glucoside		 78.57
C00039484 Jasminodiol
(-)-Jasminodiol		 78.57
C00043206 5-(4-Pentenyl)-2-furaldehyde 78.57
C00043215 5-Pentyl-2-furaldehyde 78.57
C00043415 Crocusatin L
(+)-Crocusatin L		 78.57
C00045805 Crocusatin G
(+)-Crocusatin G		 78.57
C00010557 Gelsemide 78.13
C00000370 Virginiae butanolide E 76.67
C00000377 NFX-4 76.67
C00030543 Isopropyl beta-D-glucopyranoside 76.67
C00038955 Decarestrictine D
(-)-Decarestrictine D		 76.67
C00039439 Isoespintanol 76.67
C00045563 3-Hydroxy-beta-ionone 76.67
C00000554 6-Hydroxymellein
6HM		 75.86
C00001550 Pantothenic acid 75.86
C00010393 7-Bromo-4,6,8-trichloro-2,6-dimethyl-1,4-octadien-3-one 75.86
C00010956 (+)-Paeonilactone B
Paeonilactone-B		 75.86
C00015152 CJ 15801 75.86
C00020088 3,4,-Dihydro-6-hydroxy-4,7-dimethyl-2H-1-benzopyran-2-one 75.86
C00020989 Clavukerin C 75.86
C00023643 (+)-Epoxydon monoacetate 75.86
C00025576 Isoharringtonic acid 75.86
C00028032 Cerpegin 75.86
C00036654 7-Hydroxy viteoid II
(-)-7-Hydroxy viteoid II		 75.86
C00037284 Hyacinthacine B1
(+)-Hyacinthacine B1
(1S,2R,3R,5R,7aR)-1,2-Dihydroxy-3,5-dihydroxymethylpyrrolizidine		 75.86
C00037285 Hyacinthacine B2
(+)-Hyacinthacine B2
(1S,2R,3R,5S,7aR)-1,2-Dihydroxy-3,5-dihydroxymethylpyrrolizidine		 75.86
C00037526 Mussaenin A 75.86
C00037964 Tschimganical A
(+)-Tschimganical A		 75.86
C00040378 Stagonolide D
(-)-Stagonolide D		 75.86
C00043916 Shinanolone 75.86
C00044407 (4S)-Shinanolone
(+)-(4S)-Shinanolone		 75.86
C00048669 Curvulide A
(+)-Curvulide A		 75.86
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