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


and

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




INPUT WORD = C00044509 , 50% or more
[ Metabolite Name : Ainigmaptilone B , (-)-Ainigmaptilone B ]
Number of matched data : 90

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00044508 Ainigmaptilone A
(+)-Ainigmaptilone A		 97.14
C00003168 Patchouli alcohol 91.43
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		 91.43
C00021249 Dihydromylione A 91.43
C00012844 [2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,7,8,8a-Octahydro-4a-methyl-alpha,8-bis(methylene)-7-oxo-2-naphthaleneacetic acid 89.19
C00021289 Patchoulan-1,12-diol 88.89
C00012015 Periplocadiol
(1alpha,2alpha,4alpha,6alpha)-(-)-1-Ethenyl-2-hydroxy-4,6-bis(1-methylethenyl)-cyclohexanemethanol		 88.57
C00012845 1-keto-alpha-Cyperone 88.57
C00012853 Isocorymbolone
[4R-(4a,4aa,6b,8a,8ab)]-Octahydro-8-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 88.57
C00021253 Plagiochilal A
Hanegokedial		 88.57
C00021900 Alpiniol 88.57
C00022330 Periplanone A 88.57
C00037985 Verticillatol
(-)-Verticillatol		 88.57
C00040307 Sinugibberodiol
(-)-Sinugibberodiol		 88.57
C00044740 Eleganodiol 88.57
C00046455 Teclenone A
(+)-Teclenone A		 88.57
C00013051 Dehydrobrachylaenolide
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-Hexahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00013077 Alloisosantonin
[3S-(3alpha,3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-hexahydro-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00020105 4-Methoxy-1,9-cadinadien-3-one 86.49
C00043344 Canusesnol E
(+)-Canusesnol E		 86.49
C00046798 Leitneridanin A
(+)-Leitneridanin A		 86.49
C00011718 Ageratriol 86.11
C00012434 (-)-1,10-Epoxy-4(14)-lepidozen-5-ol
1,10-Epoxy-4(14)-lepidozen-5-ol		 86.11
C00012741 [1aR-(1aalpha,2alpha,4aalpha,7alpha,8aS*)]-Octahydro-1a,4a-dimethyl-7-(1-methylethenyl)-3H-naphth[1,8a-b]oxiren-2-ol
4alpha,5alpha-Epoxy-11-eudesmen-3alpha-ol		 86.11
C00020324 Dehydrooreadone 86.11
C00021441 Deoxyilludin M 86.11
C00021749 alpha-Isocedrene-14,15-dial 86.11
C00035957 6beta,14-Epoxyeudesm-4(15)-en-1beta-ol
(+)-6beta,14-Epoxyeudesm-4(15)-en-1beta-ol		 86.11
C00003163 Lubimin 85.71
C00011715 Periplanone C
Periplanone D1		 85.71
C00011716 (-)-Periplanone D
Periplanone D
Periplanone D2		 85.71
C00011727 Aristolactone 85.71
C00012006 Saussurea lactone
(all-S)-Hexahydro-7-isopropenyl-3,6-dimethyl-6-vinyl-2(3H)-benzofuranone		 85.71
C00012013 [1S-(1alpha,2beta,3alpha,5alpha)]-2-Ethenyl-2-methyl-3,5-bis(1-methylethenyl)-cyclohexanol 85.71
C00012048 Occidiol
Occidenol		 85.71
C00012502 Bicyclohumulenedione
[1S-(1R*,5S*,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undecane-2,6-dione		 85.71
C00012544 (S)-4-Hydroxy-3-(1,2,2-trimethylcyclopentyl)benzaldehyde
(-)-alpha-Formylherbertenol		 85.71
C00012722 7-Hydroxy-beta-costol
(+)-7-Hydroxycostol
Petrovin B
[2S-(2alpha,4abeta,8aalpha)]-Decahydro-2-hydroxy-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 85.71
C00012724 alpha-Costic acid
Eudesma-3,11(13)-dien-12-oic acid
[2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid		 85.71
C00012727 Costic acid
Costus acid		 85.71
C00012748 Isocyperol
(-)-Eudesma-4(14),11-dien-3alpha-ol
[2R-(2alpha,4abeta,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-2-naphthalenol		 85.71
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		 85.71
C00012765 Cryptomeridiol
Proximadiol
Selina-4,7-diol
Selinane-4alpha,11-diol		 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
C00012819 Eudesm-4(14)-en-9-one 85.71
C00013217 Chamaecynone
Chamecynone
[1S-(1alpha,4abeta,7beta,8abeta)]-7-Ethynyl-4a,5,6,7,8,8a-hexahydro-1,4a-dimethyl-2(1H)-naphthalenone		 85.71
C00013218 Isochamaecynone
[1R-(1alpha,4aalpha,7alpha,8aalpha)]-7-ethynyl-4a,5,6,7,8,8a-Hexahydro-1,4a-dimethyl-2(1H)-naphthalenone		 85.71
C00013572 Torilenol
(1R,1aR,1bS,5R,5aR,6aR)-Decahydro-5a-methyl-2-methylene-1-(1-methylethyl)cycloprop[a]inden-5-ol		 85.71
C00016978 Dihydrocapsenone
[3R-(3alpha,4alpha,4abeta,6beta,8abeta)]-Octahydro-3-hydroxy-4,4a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 85.71
C00016990 Eremophila-1,11-dien-9-one 85.71
C00017016 [3S-(3alpha,4aalpha,5alpha,6beta,8aalpha)]-Octahydro-6-hydroxy-4a,5-dimethyl-3-(1-methylethenyl)-1(2H)-naphthalenone 85.71
C00017469 1(10)-Aristolen-12-al
[1S-(1alpha,1aalpha,7alpha,7aalpha,7balpha)]-1a,2,3,5,6,7,7a,7b-octahydro-1,7,7a-trimethyl-1H-cyclopropa[a]naphthalene-1-carboxaldehyde		 85.71
C00017509 Cinariolide 85.71
C00017514 Kanokonol
14-Hydroxyvaleranone		 85.71
C00020061 1,9-Cadinadien-3-one 85.71
C00020078 (1R-trans)-1,2,3,4-Tetrahydro-7-hydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenemethanol 85.71
C00020239 (+)-Oplopanone 85.71
C00020240 Oplopanone
(-)-Oplopanone		 85.71
C00020244 1(10)-Oplopene-4,9-dione 85.71
C00021248 (-)-Myliol
Myliol		 85.71
C00021321 4-Longipinanone 85.71
C00021340 beta-Pinguisenediol 85.71
C00021564 Isofurodysinin 85.71
C00021910 Cyperolone 85.71
C00021984 Lemnalol 85.71
C00022006 Cyperusol C 85.71
C00022015 Ligucyperonol 85.71
C00023359 3beta,8beta,15-Trihydroxy-ent-labda-13E-ene 85.71
C00023915 Dihydroprehelminthosporol 85.71
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 85.71
C00030610 Kikkanol B
(-)-Kikkanol B		 85.71
C00031161 Rhombidiol
(-)-Rhombidiol		 85.71
C00033140 Madolin E
(+)-Madolin E		 85.71
C00033674 beta-Copaen-4-alpha-ol 85.71
C00035496 4,5-epi-Cryptomeridiol 85.71
C00036989 Cyclomyltaylenol 85.71
C00037586 Orientalol F 85.71
C00037935 Trifarienol A
(+)-Trifarienol A		 85.71
C00037936 Trifarienol B
(-)-Trifarienol B		 85.71
C00037939 Trifarienol E 85.71
C00038725 Chaenocephalol 85.71
C00040945 Dictyophorin B 85.71
C00043348 Canusesnol I
(+)-Canusesnol I		 85.71
C00043675 Lubiminol
(+)-Lubiminol		 85.71
C00044484 7-Epi-eudesm-4(15)-ene-1beta,6beta-diol 85.71
C00046261 Oxyphyllol B
(+)-Oxyphyllol B		 85.71
C00046456 Teclenone B
(+)-Teclenone B		 85.71
C00048387 Eudesma-4(15),7-dien-1beta-ol
Eudesma-4(15),7-dien-1-beta-ol		 85.71
C00050331 Artabotrol 85.71
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