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


and

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




INPUT WORD = C00013550 , 50% or more
[ Metabolite Name : Axisonitrile 1 , (1R,3aR,7aR)-Octahydro-1-[(1S)-1-isocyano-2-methylpropyl]-3a-methyl-7-methylene-1H-indene ]
Number of matched data : 95

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012822 (1alpha,2beta,4aalpha,8aalpha)-Decahydro-1-isocyano-4a-methyl-8-methylene-2-(1-methylethyl)-naphthalene
6-Isocyano-4(15)-eudesmene		 94.29
C00013551 Axisonitrile 4
(1R,3aR,7aR)-Octahydro-1-(1-isocyano-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 94.29
C00013244 Axamide 1
[1R-[1alpha(S*),3aalpha,7aalpha]]-N-[2-Methyl-1-(octahydro-3a-methyl-7-methylene-1H-inden-1-yl)propyl]formamide		 91.89
C00013549 Axisothiocyanate 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isothiocyanato-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 91.89
C00013552 Axisothiocyanate 4
(1R,3aR,7aR)-Octahydro-1-(1-isothiocyanato-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 91.89
C00012682 Acanthellin 1
[1S-(1alpha,2beta,4abeta,8alpha,8aalpha)]-Decahydro-1-isocyano-4a,8-dimethyl-2-(1-methylethenyl)naphthalene		 91.43
C00039328 Halichonadin C
(-)-Halichonadin C		 91.43
C00046456 Teclenone B
(+)-Teclenone B		 91.43
C00013548 Axamide 4
N-[2-Methyl-1-[(1R,3aR,7aR)-octahydro-3a-methyl-7-methylene-1H-inden-1-yl]-1-propenyl]-formamide		 89.19
C00013555 Octahydro-1-(1-methoxy-2-methylpropyl)-3a-methyl-7-methylene-1H-inden-4-ol 89.19
C00021242 Axisonitrile 2 88.89
C00021978 9-Isocyanopupukeanane 88.89
C00021979 9-epi-9-Isocyanopupukeanane 88.89
C00011921 3-Isocyanotheonellin
Theonellin isocyanide		 88.57
C00012688 Isobrasudol
[2S-(2alpha,4abeta,5beta,8aalpha)]-5-Bromodecahydro-4a-methyl-8-methylene-2-(1-methylethyl)-2-naphthalenol		 88.57
C00012722 7-Hydroxy-beta-costol
(+)-7-Hydroxycostol
Petrovin B
[2S-(2alpha,4abeta,8aalpha)]-Decahydro-2-hydroxy-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 88.57
C00013554 [1R-(1alpha,3abeta,4beta,7aalpha)]-Octahydro-3a-methyl-7-methylene-1-(2-methyl-2-propenyl)-1H-inden-4-ol 88.57
C00013572 Torilenol
(1R,1aR,1bS,5R,5aR,6aR)-Decahydro-5a-methyl-2-methylene-1-(1-methylethyl)cycloprop[a]inden-5-ol		 88.57
C00017465 (+)-Chiloscypholone
Chiloscypholone		 88.57
C00021426 6-Isodaucene 14-isonitrile 88.57
C00021648 Axisonitrile 3 88.57
C00036302 (+)-Dihydrochiloscypholone 88.57
C00046455 Teclenone A
(+)-Teclenone A		 88.57
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 86.49
C00021666 Acanthene B 86.49
C00031494 11-Methoxyopposit-4(15)-en-1beta-ol 86.49
C00003306 Isoalantolactone
Isoallantolactone
Isohelenin		 86.11
C00012878 [3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-Decahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Dihydroallitrisin		 86.11
C00012890 Isoasterolide A
[3R-(3alpha,4aalpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one		 86.11
C00012891 Isoasterolide B
[3S-(3alpha,4abeta,8aalpha)]-4,4a,5,6,7,8,8a,9-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one		 86.11
C00021210 1-Isocyanoaromadendrane 86.11
C00021977 2-Isocyanopupukeanane 86.11
C00038562 Axinynitrile A
(+)-Axinynitrile A		 86.11
C00000164 (+)-beta-Eudesmol
beta-Eudesmol		 85.71
C00003123 Cycloeudesmol 85.71
C00003186 beta-Eudesmene
beta-Selinene		 85.71
C00012689 Brasudol
[2R-(2alpha,4aalpha,5alpha,8abeta)]-5-Bromodecahydro-a,a,4a-trimethyl-8-methylene-2-naphthalenemethanol		 85.71
C00012703 4,11-Epoxy-cis-eudesmane 85.71
C00012715 (-)-beta-Selinene
(-)-Eudesma-4(14),11-diene
[4aS-(4aalpha,7alpha,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 85.71
C00012716 5beta,10alpha-Eudesma-4(14),11-diene
[4aS-(4aalpha,7beta,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 85.71
C00012717 [4aR-(4aalpha,7alpha,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene 85.71
C00012718 beta-Helmiscapene
[4aR-(4aalpha,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 85.71
C00012723 (+)-7-Hydroxycostal 85.71
C00012746 beta-Dictyopterol
(1alpha,4abeta,6alpha,8aalpha)-(+-)-Decahydro-8a-methyl-4-methylene-6-(1-methylethenyl)-1-naphthalenol		 85.71
C00012747 Dictyopterone
Eudesma-4(14),11-dien-1-one		 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
C00012765 Cryptomeridiol
Proximadiol
Selina-4,7-diol
Selinane-4alpha,11-diol		 85.71
C00012766 (-)-10-epi-5beta,11-Dihydroxyeudesmane
[2R-(2alpha,4abeta,8alpha,8aalpha)]-Decahydro-8a-hydroxy-a,a,4a,8-tetramethyl-2-naphthalenemethanol		 85.71
C00012781 [2R-(2alpha,4aalpha,5alpha,8abeta)]-Decahydro-5-hydroxy-a,a,4a-trimethyl-8-methylene-2-naphthalenemethanol 85.71
C00012782 (+)-Pterocarpol
Eudesm-4(14)-ene-2a,11-diol
[2R-(2alpha,4aalpha,6beta,8abeta)]-decahydro-6-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 85.71
C00012786 Kudtdiol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 85.71
C00012789 2-(1,4,4a,5,6,7,8,8a-Octahydro-4a,8-dimethyl-2-naphthalenyl)-1,2-propanediol 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
C00012792 Ilicic alcohol
Iliciol
[2R-(2alpha,4aalpha,8beta,8abeta)]-Decahydro-8-hydroxy-4a,8-dimethyl-b-methylene-2-naphthaleneethanol		 85.71
C00012804 Eudesm-4(15)-en-5-ol
[3R-(3alpha,4abeta,8aalpha)]-Octahydro-8a-methyl-5-methylene-3-(1-methylethyl)-4a(2H)-naphthalenol		 85.71
C00012812 Isointermedeol 85.71
C00012813 Kongol
Selin-11-en-4alpha-ol
5alpha,7alphaH-Eudesm-11(13)en-4alpha-ol
[1R-(1alpha,4abeta,7beta,8aalpha)]-decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol		 85.71
C00012814 Amiteol
[1R-(1alpha,4abeta,7beta,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol		 85.71
C00012815 neo-Intermedeol
(-)-Neointermedeol
Neointermedeol
[1S-(1alpha,4aalpha,7alpha,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol		 85.71
C00012816 (+)-Intermedeol
5beta,10alpha-Eudesm-11-en-4-ol
Intermedeol		 85.71
C00012818 (2R-trans)-3,4,4a,5,6,7-Hexahydro-2-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone
7alpha-Hydroxyneoacolamone		 85.71
C00012819 Eudesm-4(14)-en-9-one 85.71
C00012853 Isocorymbolone
[4R-(4a,4aa,6b,8a,8ab)]-Octahydro-8-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 85.71
C00012950 (-)-Stylotelline
Stylotelline
[1R-(1alpha,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-8a-isocyano-1,4a-dimethyl-7-propylnaphthalene		 85.71
C00013103 Deoxybaimuxinol
Dihydro-beta-agarofuran
trans-Dihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin		 85.71
C00013553 (1R,3aR,4R,7aS)-Octahydro-3a-methyl-7-methylene-1-(2-methyl-1-propenyl)-1H-inden-4-ol
[1R-(1alpha,3abeta,4beta,7aalpha)]-octahydro-3a-methyl-7-methylene-1-(2-methyl-1-propenyl)-1H-inden-4-ol		 85.71
C00013557 Oppositol
(3S,3aS,4R,7S,7aS)-7-Bromooctahydro-4,7a-dimethyl-3-(2-methyl-1-propenyl)-1H-inden-4-ol		 85.71
C00013573 Isocycloeudesmol
Hexahydro-alpha,alpha,3a,7-tetramethyl-1H-cycloprop[c]indene-1a(2H)-methanol		 85.71
C00013589 Ent-maaliane-5-ol
(1aS,3aR,7S,7aS,7bR)-Decahydro-1,1,3a,7-tetramethyl-7aH-cyclopropa[a]naphthalen-7a-ol		 85.71
C00016958 gamma-Maaliene 85.71
C00016966 (-)-Maalioxide
Ventricosin B		 85.71
C00017514 Kanokonol
14-Hydroxyvaleranone		 85.71
C00021385 Ferutinol
Jaeschkeanadiol		 85.71
C00021827 Presilphiperfolanol 85.71
C00021849 (+)-alpha-Santalan-12-one 85.71
C00022000 Sesquithuriferone 85.71
C00022006 Cyperusol C 85.71
C00022645 Medhephenepoxide 85.71
C00030077 Cyclomyltaylane-5beta-ol 85.71
C00031161 Rhombidiol
(-)-Rhombidiol		 85.71
C00033660 beta-Ylangene 85.71
C00035496 4,5-epi-Cryptomeridiol 85.71
C00035570 Cyclosantalal 85.71
C00035608 epi-Cyclosantalal
Epicyclosantalal		 85.71
C00036292 (-)-trans-Selina-4(15),11-dien-5-ol 85.71
C00036989 Cyclomyltaylenol 85.71
C00037125 Eudesm-4(15)-en-7-ol
(+)-Eudesm-4(15)-en-7alpha-ol		 85.71
C00037985 Verticillatol
(-)-Verticillatol		 85.71
C00041641 Mairetin
(-)-Mairetin		 85.71
C00044033 (+)-beta-Copaene 85.71
C00044887 Litseahumulane B
(-)-Litseahumulane B		 85.71
C00048329 beta-Copaene 85.71
C00049777 4alpha-Isocyanogorgon-11-ene 85.71
C00049951 4alpha-Hydroxyeudesm-11-en-12-al 85.71
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