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


and

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




INPUT WORD = C00045374 , 50% or more
[ Metabolite Name : Phomapentenone A , (-)-Phomapentenone A ]
Number of matched data : 82

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035033 8-Hydroxy-pentadeca-(9E,13Z)-dien-11-yn-2-one 88.24
C00049261 Penihydrone
(+)-Penihydrone		 88.24
C00011528 Cyclonerotriol 86.11
C00012887 Asterolide
Atractylenolide II
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 86.11
C00012888 8-Epiasterolide
[4aS-(4aalpha,8abeta,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 86.11
C00012892 Neoalantolactone 86.11
C00017488 Lemnaliadione 86.11
C00011378 2,10-Dihydroxy-2,6,10-trimethyl-3,6,11-dodecatrien-5-one 85.71
C00011380 5,10-Dihydroxy-2,6,10-trimethyl-2,6,11-dodecatrien-4-one
Vernopolyanthone		 85.71
C00012355 Furanocaulesone B 85.71
C00012356 Furanocaulesone C 85.71
C00017016 [3S-(3alpha,4aalpha,5alpha,6beta,8aalpha)]-Octahydro-6-hydroxy-4a,5-dimethyl-3-(1-methylethenyl)-1(2H)-naphthalenone 85.71
C00041755 Phomallenic acid A
(-)-Phomallenic acid A		 85.71
C00047658 2-Keto-5-hydroxyguai-3,11-diene
(+)-2-Keto-5-hydroxyguai-3,11-diene		 85.71
C00000226 (+)-9,10-Dihydro-7-iso-jasmonic acid 85.29
C00000230 (1S,2S)-3-Oxo-2[(2Z)-pentenyl]cyclopentane-1-butyric acid 85.29
C00000361 OPC-4:0 85.29
C00001286 Ichthyotherol 85.29
C00011396 (E,E)-10-hydroxy-2,6,10-trimethyl-2,6,11-Dodecatrienal 85.29
C00011397 8-Oxonerolidol 85.29
C00011417 3,7,11-Trimethyl-1,4,6,10-dodecatetraene-3,8-diol 85.29
C00011423 12-Hydroxy-trans-nerolidol
(E,E)-2,6,10-trimethyl-2,6,11-Dodecatriene-1,10-diol		 85.29
C00011424 (Z,E)-2,6,10-trimethyl-2,6,11-Dodecatriene-1,10-diol 85.29
C00011521 Chokol C
(-)-Chokol C		 85.29
C00011522 Chokol D
(-)-Chokol D		 85.29
C00012806 Acolamone
[2S-(2alpha,4aalpha,8abeta)]-Octahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1(2H)-naphthalenone		 85.29
C00021584 Shizuka-acoradienol 85.29
C00021651 Axenol
(-)-Axenol
Gleenol		 85.29
C00021652 (+)-Axenol 85.29
C00021822 Silphiperfol-6-en-5-one
6-Silphiperfolen-5-one		 85.29
C00021875 Isoishwarone
endo-Isoishwarone		 85.29
C00034533 Herbarumin II
(+)-Herbarumin II		 85.29
C00042019 (Z)-1beta-hydroxy-2-hydrolanceol 85.29
C00020837 Eregoyazin 84.21
C00021010 3beta-Hydroxy-4beta,15,11a,13-tetrahydrodehydrocostuslactone 84.21
C00011514 (-)-Kindon ketol
Kindon ketol		 83.78
C00011610 Bisabolangelone
Angelikoreanol
Ligustilone		 83.78
C00021398 Isolancerotriol 83.78
C00047455 Illifunone C 83.78
C00000470 Deacetyllaurencin 83.33
C00003306 Isoalantolactone
Isoallantolactone
Isohelenin		 83.33
C00012415 [2alpha(Z),3alpha(E)]- 3-Methyl-4-[tetrahydro-3-(3-methyl-1,3-butadienyl)-4-methylene-5-oxo-2-furanyl]-2-butenal 83.33
C00012878 [3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-Decahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Dihydroallitrisin		 83.33
C00021013 5,10-bis-epi-Isoalantolactone 83.33
C00021021 11beta,13-Dihydro-desoxo-achalensolide 83.33
C00031253 Rumphellolide C
(-)-Rumphellolide C		 83.33
C00044268 N-Methyl-2,6-bis-(2-hydroxypentyl)-piperidine 83.33
C00047002 Andrachcine
(-)-Andrachcine		 83.33
C00047004 Andrachcinine
(-)-Andrachcinine		 83.33
C00003125 Debneyol 82.86
C00003292 Glechomanolide 82.86
C00012354 Furanocaulesone A 82.86
C00012358 Furanogermenone 82.86
C00012460 (1R*,3E,7E,11S*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-methanol
1alpha,10beta-Epoxy-alpha-humulen-14-ol		 82.86
C00012461 (1R*,3E,7E,11R*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-carboxaldehyde
6alpha,7beta-Epoxy-2,9-humuladien-14-al		 82.86
C00012487 Buddledin B 82.86
C00012502 Bicyclohumulenedione
[1S-(1R*,5S*,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undecane-2,6-dione		 82.86
C00012777 alpha-Chenopodiol
[1R-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-octahydro-1-hydroxy-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 82.86
C00012783 beta-Chenopodiol
4(14)-Eudesmene-6a,11-diol
[1R-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-1-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 82.86
C00012785 Arctiol
[2S-(2alpha,3beta,4aalpha,8abeta)]-Decahydro-3-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 82.86
C00012790 alpha-Corymbolol
1,[1S-(1alpha,4beta,4aalpha,6beta,8abeta)]-Octahydro-4,8a-dimethyl-6-(1-methylethenyl)-4a(2H)-naphthalenediol		 82.86
C00012791 Corymbolone
[4S-(4alpha,4abeta,6alpha,8aalpha)]-Octahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 82.86
C00017291 9-Oxo-1(10),11(13)-eremophiladien-12-al 82.86
C00017465 (+)-Chiloscypholone
Chiloscypholone		 82.86
C00020107 Schisandronol 82.86
C00020415 1-Hydroxy-4,11-guaiadien-3-one 82.86
C00021340 beta-Pinguisenediol 82.86
C00021385 Ferutinol
Jaeschkeanadiol		 82.86
C00021585 Acoronene 82.86
C00021705 Germacrene-D-lactone 82.86
C00021711 Laurenone A 82.86
C00023915 Dihydroprehelminthosporol 82.86
C00027644 (E)-7-Methoxytetradec-4-enoic acid 82.86
C00031907 Isokhusinodiol
(-)-Isokhusinodiol		 82.86
C00031954 Khusinodiol 82.86
C00035842 iso-Acorone 82.86
C00036128 Isovaleroyloxylinalool 82.86
C00036302 (+)-Dihydrochiloscypholone 82.86
C00037985 Verticillatol
(-)-Verticillatol		 82.86
C00038751 Chlorantene G
(+)-Chlorantene G		 82.86
C00046256 Oxyphyllenodiol A
(+)-Oxyphyllenodiol A		 82.86
C00049951 4alpha-Hydroxyeudesm-11-en-12-al 82.86
Page Top