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


and

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




INPUT WORD = C00017007 , 50% or more
[ Metabolite Name : (+)-Isopetasol , Isopetasol , 3alpha-Hydroxy-eremophila-7(11),9-dien-8-one ]
Number of matched data : 69

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00017009 (+)-Petasol
Petasol
Sencathenone		 97.14
C00017014 Hydroxyeremophilone 97.14
C00017004 Isopetasan
Dehydrofukinone
3-Desoxyisopetasol		 94.29
C00038563 Axinysone A
(+)-Axinysone A		 91.67
C00038564 Axinysone B
(+)-Axinysone B		 91.67
C00016995 Warburgiadione
Eremophila-1,7(11),9-triene-3,8-dione		 91.43
C00029294 (+)-Aristolone 91.43
C00016970 Eremofortin B 89.47
C00017295 Sporogen AO 1
(+)-13-Deoxyphomenone		 89.47
C00017375 (4aR-cis)-4a,5,6,7-Tetrahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-8(4H)-one 88.89
C00003108 Capsidiol 88.57
C00011676 6-(1,5-Dimethyl-4-hexenyl)-6-hydroxy-3-methyl-2-cyclohexen-1-one 88.57
C00016977 Capsenone 88.57
C00016991 Alloeremophilone
3-Desoxyneopetasol
Eremophila-9,11-dien-8-one
Neopetasan		 88.57
C00017003 Fukinone
(+)-Eremophil-7(11)-en-8-one		 88.57
C00017339 9,10-Dehydrofuranoeremophilane 88.57
C00020416 Procurcumenol 88.57
C00029543 4S-Dihydrocurcumenone 88.57
C00030068 Curcumenone 88.57
C00041773 Pleodendione 88.57
C00043347 Canusesnol H
(+)-Canusesnol H		 88.57
C00038565 Axinysone C
(+)-Axinysone C		 86.84
C00043346 Canusesnol G
(+)-Canusesnol G		 86.49
C00003225 Bakkenolide A 86.11
C00003258 Eremofrullanolide 86.11
C00003259 Eremophilenolide
Eremophylenolide		 86.11
C00017336 Tetrahydroligularenolide 86.11
C00017337 Dihydroeremofrullanolide 86.11
C00017374 Furoeremophilone 1 86.11
C00017376 8,12-Epoxy-10alpha-Eremophila-7,11-dien-9-one 86.11
C00021012 [3aR-(3aalpha,4abeta,5beta,9aalpha)]-3a,4,4a,5,6,7,8,9a-Octahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one 86.11
C00021749 alpha-Isocedrene-14,15-dial 86.11
C00011381 8,10-Dihydroxy-2,6,10-trimethyl-2,6,11-dodecatrien-4-one 85.71
C00011428 3,7,11-Trimethyl-1,6,10-dodecatriene-3,5-diol 85.71
C00011431 [3R-(3R*,5S*,6E,9S*)]-3,7,11-trimethyl-1,6,10-dodecatriene-3,5,9-triol 85.71
C00011516 Caulolactone B 85.71
C00011517 Caulolactone A 85.71
C00011675 [4R-[4alpha,6alpha(S*)]]-6-(1,5-Dimethyl-4-hexenyl)-4-hydroxy-3-methyl-2-cyclohexen-1-one 85.71
C00011680 [S-[R*,S*-(E)]]-2-Methyl-6-(4-methyl-2-oxo-3-cyclohexen-1-yl)-2-heptenal 85.71
C00012490 5-Hydroxy-5,6-secocaryophyllen-6-one 85.71
C00012790 alpha-Corymbolol
1,[1S-(1alpha,4beta,4aalpha,6beta,8abeta)]-Octahydro-4,8a-dimethyl-6-(1-methylethenyl)-4a(2H)-naphthalenediol		 85.71
C00012791 Corymbolone
[4S-(4alpha,4abeta,6alpha,8aalpha)]-Octahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 85.71
C00012853 Isocorymbolone
[4R-(4a,4aa,6b,8a,8ab)]-Octahydro-8-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 85.71
C00016976 (-)-Aristolochene
Aristolochen
Aristolochene		 85.71
C00016978 Dihydrocapsenone
[3R-(3alpha,4alpha,4abeta,6beta,8abeta)]-Octahydro-3-hydroxy-4,4a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 85.71
C00016981 [2R-(2alpha,8alpha,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-8,8a-dimethyl-a-methylene-2-naphthaleneacetic acid 85.71
C00016988 Isofukinone 85.71
C00017016 [3S-(3alpha,4aalpha,5alpha,6beta,8aalpha)]-Octahydro-6-hydroxy-4a,5-dimethyl-3-(1-methylethenyl)-1(2H)-naphthalenone 85.71
C00017470 alpha-Ferulene
(+)-9-Aristolene		 85.71
C00017471 (-)-9-Aristolene
Aristolene
(-)-Aristolene		 85.71
C00017472 (-)-1abeta,2,4alpha,5,6,7,7a,7bbeta-Octahydro-1,1,7beta,7abeta-tetramethyl-1H-cyclopropa[a]naphthalen-4-ol 85.71
C00020244 1(10)-Oplopene-4,9-dione 85.71
C00020385 Dolichlasin 85.71
C00021385 Ferutinol
Jaeschkeanadiol		 85.71
C00021858 Clausantalene 85.71
C00021874 3-Oxoishwarane 85.71
C00021955 Tanavulgarol 85.71
C00032260 Sugikurojinol A
(4S)-2,6,10-Bisaboratrien-4-ol-1-one		 85.71
C00032572 (3R,4R,6S)-3,4-Epoxybisabola-7(14),10-dien-2-one
(-)-(3R,4R,6S)-3,4-Epoxybisabola-7(14),10-dien-2-one		 85.71
C00035842 iso-Acorone 85.71
C00036300 (+)-Aristolochene 85.71
C00036367 1,15-Dihydroxyherbertene 85.71
C00037985 Verticillatol
(-)-Verticillatol		 85.71
C00040487 Thujopsenol 85.71
C00041900 Suberosenone
(+)-Suberosenone		 85.71
C00042682 Laur-11-en-2,10-diol 85.71
C00044449 3-epi-Perforenone A 85.71
C00046262 Oxyphyllol C
(+)-Oxyphyllol C		 85.71
C00046456 Teclenone B
(+)-Teclenone B		 85.71
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