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


and

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




INPUT WORD = C00013549 , 50% or more
[ Metabolite Name : Axisothiocyanate 1 , (1R,3aR,7aR)-Octahydro-1-[(1S)-1-isothiocyanato-2-methylpropyl]-3a-methyl-7-methylene-1H-indene ]
Number of matched data : 59

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013244 Axamide 1
[1R-[1alpha(S*),3aalpha,7aalpha]]-N-[2-Methyl-1-(octahydro-3a-methyl-7-methylene-1H-inden-1-yl)propyl]formamide		 94.59
C00013552 Axisothiocyanate 4
(1R,3aR,7aR)-Octahydro-1-(1-isothiocyanato-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 94.59
C00013548 Axamide 4
N-[2-Methyl-1-[(1R,3aR,7aR)-octahydro-3a-methyl-7-methylene-1H-inden-1-yl]-1-propenyl]-formamide		 91.89
C00013550 Axisonitrile 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isocyano-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 91.89
C00021666 Acanthene B 91.89
C00038560 Axinisothiocyanate M
(-)-Axinisothiocyanate M		 89.74
C00021245 Epipolasin B 89.47
C00011922 Theonellin isothiocyanate 89.19
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 89.19
C00013555 Octahydro-1-(1-methoxy-2-methylpropyl)-3a-methyl-7-methylene-1H-inden-4-ol 89.19
C00031494 11-Methoxyopposit-4(15)-en-1beta-ol 89.19
C00013577 (-)-Epipolasin A 86.84
C00021211 1-Isothiocyanatoaromadendrane 86.84
C00021243 10alpha-Isothiocyanatoalloaromadendrane 86.84
C00021244 Axisothiocyanate 2 86.84
C00012822 (1alpha,2beta,4aalpha,8aalpha)-Decahydro-1-isocyano-4a-methyl-8-methylene-2-(1-methylethyl)-naphthalene
6-Isocyano-4(15)-eudesmene		 86.49
C00013551 Axisonitrile 4
(1R,3aR,7aR)-Octahydro-1-(1-isocyano-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 86.49
C00021427 6-Isodaucene 14-isothiocyanate 86.49
C00021647 Axisothiocyanate 3 86.49
C00021664 10-Isothiocyanatoguai-6-ene 86.49
C00046456 Teclenone B
(+)-Teclenone B		 86.49
C00013576 Epipolasin A
(1aR,3aS,7S,7aS,7bR)-Decahydro-7-isothiocyanato-1,1,3a,7-tetramethyl-1H-cyclopropa[a]naphthalene		 84.21
C00021241 Axamide 2 84.21
C00049930 2-(Formylamino)trachyopsane
(-)-2-(Formylamino)trachyopsane		 84.21
C00011920 Theonellin formamide 83.78
C00012682 Acanthellin 1
[1S-(1alpha,2beta,4abeta,8alpha,8aalpha)]-Decahydro-1-isocyano-4a,8-dimethyl-2-(1-methylethenyl)naphthalene		 83.78
C00012685 Heterocladol
[1R-(1a,4alpha,4aalpha,7alpha,8beta,8abeta)]-4-Bromo-8-chlorodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-naphthalenol		 83.78
C00012688 Isobrasudol
[2S-(2alpha,4abeta,5beta,8aalpha)]-5-Bromodecahydro-4a-methyl-8-methylene-2-(1-methylethyl)-2-naphthalenol		 83.78
C00012691 [1R-(1alpha,4alpha,4aalpha,7beta,8abeta)]-4-Bromo-7-chlorodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-naphthalenol 83.78
C00012722 7-Hydroxy-beta-costol
(+)-7-Hydroxycostol
Petrovin B
[2S-(2alpha,4abeta,8aalpha)]-Decahydro-2-hydroxy-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 83.78
C00012786 Kudtdiol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 83.78
C00012789 2-(1,4,4a,5,6,7,8,8a-Octahydro-4a,8-dimethyl-2-naphthalenyl)-1,2-propanediol 83.78
C00012799 (+)-Kudtriol
Kudtriol
Kutdtriol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 83.78
C00012800 5-epi-Kudtriol
5-epi-Kutdtriol
[2R-[2alpha(R*),4aalpha,8aalpha]]-2-(Decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 83.78
C00013554 [1R-(1alpha,3abeta,4beta,7aalpha)]-Octahydro-3a-methyl-7-methylene-1-(2-methyl-2-propenyl)-1H-inden-4-ol 83.78
C00013571 Crispatanolide
(3R,4aS,4bR,5aR,6aR)-Hexahydro-4b-methyl-3-(1-methylethyl)-3H-3,6a-ethano-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyran-1-one		 83.78
C00013572 Torilenol
(1R,1aR,1bS,5R,5aR,6aR)-Decahydro-5a-methyl-2-methylene-1-(1-methylethyl)cycloprop[a]inden-5-ol		 83.78
C00016980 cis-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylenenaphthaleneacetic acid methyl ester 83.78
C00017465 (+)-Chiloscypholone
Chiloscypholone		 83.78
C00020115 1-Isothiocyanato-4-muurolene 83.78
C00020278 Isoalbrassitriol 83.78
C00021242 Axisonitrile 2 83.78
C00021601 Hurgadol 83.78
C00021623 Obtusane 83.78
C00021645 Acanthisothiocyanate 3 83.78
C00021665 10-Isothiocyanato-4-cadinene 83.78
C00021668 (1R,6S,7S,10S)-10-Isothiocyanato-4-amorphene
10-Isothiocyanato-4-amorphene		 83.78
C00021670 Axisocyanate 3 83.78
C00021978 9-Isocyanopupukeanane 83.78
C00021979 9-epi-9-Isocyanopupukeanane 83.78
C00033538 1beta,4beta,7alpha-Trihydroxyeudesmane
(-)-1beta,4beta,7alpha-Trihydroxyeudesmane		 83.78
C00036302 (+)-Dihydrochiloscypholone 83.78
C00038558 Axinisothiocyanate K
(+)-Axinisothiocyanate K		 83.78
C00038809 Clypeotriol
(+)-Clypeotriol		 83.78
C00039328 Halichonadin C
(-)-Halichonadin C		 83.78
C00043115 Vittatalactone 83.78
C00046272 Pannosanol
(+)-Pannosanol		 83.78
C00046455 Teclenone A
(+)-Teclenone A		 83.78
C00047110 Trichocarane C
(-)-Trichocarane C		 83.78
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