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


and

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




INPUT WORD = C00020117 , 50% or more
[ Metabolite Name : Mansonone A , 5,6,7,8-Tetrahydro-5-isopropyl-3,8-dimethyl-1,2-naphthoquinone ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003140 Helminthosporal 91.43
C00003141 Helminthosporol 91.43
C00012512 2,3-Dihydroxycuparene
(S)-3-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 91.43
C00012761 1,2-Dehydro-alpha-cyperone
(+)-Eudesma-1,4,11-trien-3-one
(4aS-cis)-5,6,7,8-Tetrahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(4aH)-naphthalenone		 91.43
C00012845 1-keto-alpha-Cyperone 91.43
C00020138 10-Hydroxy-4-muurolen-3-one 91.43
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 91.43
C00020226 9-Oxoageraphorone 91.43
C00020227 9beta-Hydroxyageraphorone 91.43
C00020415 1-Hydroxy-4,11-guaiadien-3-one 91.43
C00039901 Oleodaphnal
(+)-Oleodaphnal		 91.43
C00039902 Oleodaphnone
(+)-Oleodaphnone		 91.43
C00049304 Sootepdienone
(+)-Sootepdienone		 91.43
C00050285 Hydroxycolorenone 91.43
C00030730 Mansonone S 89.19
C00043340 Canusesnol A
(-)-Canusesnol A		 89.19
C00003149 Hydroxyisopatchoulenone 88.57
C00011544 Ancistrodial 88.57
C00011649 Ptilostemonol 88.57
C00011902 Pseudotsugonal 88.57
C00012530 Rosulantol 88.57
C00012545 (-)-Herbertenediol
Herbertenediol(S)-5-Methyl-3-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 88.57
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
C00012854 Aubergenone
Mangeudesmenone
[1R-(1alpha,4aalpha,7alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-2(1H)-naphthalenone		 88.57
C00020069 3-Hydroxy-beta-calacorene 88.57
C00020078 (1R-trans)-1,2,3,4-Tetrahydro-7-hydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenemethanol 88.57
C00020107 Schisandronol 88.57
C00020109 10-Hydroxy-cadin-4-en-3-one 88.57
C00020137 (-)-1beta,10betaH-Cadin-4-ene-3alpha,10-diol 88.57
C00020139 1beta,10betaH-Cadin-4-ene-3beta,10-diol 88.57
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 88.57
C00020184 4-Cadinene-10,14-diol 88.57
C00020224 9-Oxo-10,11-dehydroageraphorone 88.57
C00020398 1beta,10betaH-Guaia-4,11-dien-3-one 88.57
C00020417 11-Hydroxy-4-guaien-3-one 88.57
C00021206 Tridensenone 88.57
C00021240 ent-Cyclocolorenone
(+)-Cyclocolorenone		 88.57
C00021585 Acoronene 88.57
C00022791 1alpha,7alpha,10alphaH-Guaia-4,11(13)-dien-3-one 88.57
C00023915 Dihydroprehelminthosporol 88.57
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 88.57
C00029866 Cadina-1,4-diene
Cadina-1(2),4-diene
Cubenene
Cadine-1,4-diene		 88.57
C00030184 CID is old! 88.57
C00042890 Pulioplopanone A
(-)-Pulioplopanone A		 88.57
C00045807 Cubebenone
(+)-Cubebenone		 88.57
C00047359 (-)-1S,9R-9-Hydroxy-2,2,5,9-tetramethylbicyclo[6.3.0]undeca-4,7-dien-6-one 88.57
C00047658 2-Keto-5-hydroxyguai-3,11-diene
(+)-2-Keto-5-hydroxyguai-3,11-diene		 88.57
C00047669 4-Hydroxy-10-epirotundone
(-)-4-Hydroxy-10-epirotundone		 88.57
C00003364 Santonin
Semenen
(-)-alpha-Santonin
(-)-Santonin
a-Santonin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00003365 beta-Santonin
[3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
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