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


and

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




INPUT WORD = C00029298 , 50% or more
[ Metabolite Name : (+)-Dehydrovomifoliol , Dehydrovomifoliol , S-(+)-Dehydrovomifoliol ]
Number of matched data : 75

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029834 (+)-Blumenol A
Blumenol A
Roseoside aglycon
Vomifoliol
(+)-Vomifoliol		 100.00
C00042289 Blumenol B 100.00
C00043179 3,6,9-Trihydroxy-4-megastigmene 96.88
C00030026 Cucumegastigmane I 94.12
C00042295 Boscialin 93.75
C00043138 (6R,9R)-9-Hydroxy-4-megastigmen-3-one 93.75
C00048295 7,8-Dihydro-alpha-ionone
(-)-7,8-Dihydro-alpha-ionone		 93.75
C00044397 (+)-7alpha,8alpha-Epoxyblumenol B 91.43
C00021637 Majusculone 90.91
C00044091 Annuionone C
(-)-Annuionone C		 90.91
C00031308 Sarmentol A
(-)-Sarmentol A		 90.63
C00031309 Sarmentol B
(+)-Sarmentol B
9-epi-Sarmentol A		 90.63
C00031310 Sarmentol D 90.63
C00043180 3,9-Dihydroxy-4-megastigmene 90.63
C00012841 alpha-Rotunol
[4aS-(4aalpha,6beta,8abeta)]-4a,5,6,7,8,8a-hexahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone		 88.57
C00012842 (+)-beta-Rotunol
beta-Rotunol
[4aR-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-hexahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone		 88.57
C00035809 Annuionone F 88.24
C00012756 [4aR-(4aalpha,6beta,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 87.88
C00012757 [4aS-(4aalpha,6alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 87.88
C00012758 [4aS-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 87.88
C00034304 Tectoionol A
(+)-Tectoionol A		 87.88
C00035806 Annuionone A
(+)-Annuionone A		 87.88
C00043054 Tanarifuranonol
(+)-Tanarifuranonol		 87.88
C00003153 cis-alpha-Irone 87.50
C00003154 trans-alpha-Irone 87.50
C00022191 Apo-9-zeaxanthinone 87.50
C00029325 (3S,5R,6S,9R)-Megastigman-3,9-diol 87.50
C00035810 Annuionone G
(-)-Annuionone G		 87.50
C00040944 Dictyophorin A 86.11
C00012855 Isopterocarpolone
[4aR-(4aalpha,6beta,8abeta)]-4a,5,6,7,8,8a-Hexahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone		 85.71
C00043471 Drummondol 85.71
C00046528 Xenitorin E
(-)-Xenitorin E		 85.71
C00046529 Xenitorin F
(-)-Xenitorin F		 85.71
C00021325 Vulgarone B 85.29
C00021870 Mustakone 85.29
C00031307 Sarmentoic acid
(-)-Sarmentoic acid		 85.29
C00011579 Dactyloxene B 84.85
C00012734 alpha-Dictyopterol
Eudesma-3,11-dien-1beta-ol
[1S-(1alpha,4abeta,6alpha,8aalpha)]-1,2,4a,5,6,7,8,8a-Octahydro-4,8a-dimethyl-6-(1-methylethenyl)-1-naphthalenol		 84.85
C00012736 Ent-8beta-hydroxyeudesma-3,11-diene
[2S-(2alpha,3alpha,4abeta,8aalpha)]-1,2,3,4,4a,7,8,8a-Octahydro-5,8a,dimethyl-3-(1-methylethenyl)-2-naphthalenol		 84.85
C00012737 alpha-Costol
(-)-alpha-Costol
[2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-beta-methylene-2-naphthaleneethanol		 84.85
C00012755 (4aR-cis)-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethylidene)-2(1H)-naphthalenone 84.85
C00012803 7-epi-alpha-Eudesmol
[2S-(2alpha,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 84.85
C00021611 Laurencenone C 84.85
C00035807 Annuionone B
(-)-Annuionone B		 84.85
C00035808 Annuionone E
(+)-Annuionone E		 84.85
C00036277 (-)-Eudesma-3,11-dien-5-ol 84.85
C00003115 alpha-Chamigrene 84.38
C00003118 Copaene
(-)-alpha-Copaene
alpha-Copaene		 84.38
C00003203 alpha-Ylangene 84.38
C00011014 Vulgarole 84.38
C00011037 trans-Chrysanthenyl acetate 84.38
C00011559 beta-Monocyclonerolidol 84.38
C00011585 Striatol 84.38
C00012465 (E,E)-2,9,9-Trimethyl-6-methylene-2,7-cycloundecadien-1-one
gamma-Humulen-9-one		 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		 84.38
C00012710 5beta,10alpha-Eudesma-3,11-diene 84.38
C00012711 [2R-(2alpha,4aalpha,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene 84.38
C00021290 beta-Patchoulene 84.38
C00021834 alpha-Panasinsene
alpha-Panasinsanene		 84.38
C00021865 Copadiene 84.38
C00021952 Isowiddrene
alpha-Pseudowiddrene		 84.38
C00021959 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-diene-7,8-diol 84.38
C00029672 alpha-Selinene
(-)-alpha-Selinene		 84.38
C00029678 alpha-Maaliene 84.38
C00030189 epi-alpha-Selinene 84.38
C00031831 Grasshopper ketone
(-)-Grasshopper ketone		 84.38
C00032567 (1R,4S)-1-Hydroperoxy-p-menth-2-en-8-ol acetate 84.38
C00034305 Tectoionol B 84.38
C00035539 beta-Isocyclolavandulyl isobutyrate 84.38
C00036276 (-)-Eudesma-2,4(15)-11-triene 84.38
C00036298 (+)-alpha-Selinene 84.38
C00044031 (+)-alpha-Copaene 84.38
C00045806 Crocusatin H
(+)-Crocusatin H		 84.38
C00048297 7-epi-alpha-Selinene 84.38
C00048496 Nopyl acetate 84.38
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