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


and

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




INPUT WORD = C00021427 , 50% or more
[ Metabolite Name : 6-Isodaucene 14-isothiocyanate ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021426 6-Isodaucene 14-isonitrile 91.89
C00021665 10-Isothiocyanato-4-cadinene 91.89
C00021666 Acanthene B 91.89
C00021668 (1R,6S,7S,10S)-10-Isothiocyanato-4-amorphene
10-Isothiocyanato-4-amorphene		 91.89
C00038558 Axinisothiocyanate K
(+)-Axinisothiocyanate K		 91.89
C00013576 Epipolasin A
(1aR,3aS,7S,7aS,7bR)-Decahydro-7-isothiocyanato-1,1,3a,7-tetramethyl-1H-cyclopropa[a]naphthalene		 89.47
C00021211 1-Isothiocyanatoaromadendrane 89.47
C00011920 Theonellin formamide 89.19
C00011922 Theonellin isothiocyanate 89.19
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 89.19
C00021645 Acanthisothiocyanate 3 89.19
C00021664 10-Isothiocyanatoguai-6-ene 89.19
C00038559 Axinisothiocyanate L
(-)-Axinisothiocyanate L		 87.18
C00013577 (-)-Epipolasin A 86.84
C00013244 Axamide 1
[1R-[1alpha(S*),3aalpha,7aalpha]]-N-[2-Methyl-1-(octahydro-3a-methyl-7-methylene-1H-inden-1-yl)propyl]formamide		 86.49
C00013549 Axisothiocyanate 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isothiocyanato-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 86.49
C00020115 1-Isothiocyanato-4-muurolene 86.49
C00020985 Bedfordiolide 86.49
C00021424 Aphanamol II 86.49
C00021425 Aphanamol I 86.49
C00033796 Dysodensiol E
(-)-Dysodensiol E		 86.49
C00038557 Axinisothiocyanate J
(+)-Axinisothiocyanate J		 84.62
C00038560 Axinisothiocyanate M
(-)-Axinisothiocyanate M		 84.62
C00048623 Axiplyn C
(+)-Axiplyn C		 84.62
C00002224 Leontiformine 84.21
C00011725 [1S-(1R*,5E,7R*)]-4,10-bis(methylene)-7-(1-methylethyl)-5-Cyclodecen-1-ol acetate 84.21
C00021243 10alpha-Isothiocyanatoalloaromadendrane 84.21
C00021244 Axisothiocyanate 2 84.21
C00049930 2-(Formylamino)trachyopsane
(-)-2-(Formylamino)trachyopsane		 84.21
C00003222 Artemorin 83.78
C00011921 3-Isocyanotheonellin
Theonellin isocyanide		 83.78
C00012175 [3S-(3R*,3aR*,10E,11aR*)]-3a,5,6,8,9,11a-Hexahydro-3,10-dimethyl-6-methylene-cyclodeca[b]furan-2,7(3H,4H)-dione 83.78
C00012176 Anhydroverlotorin
Dehydroartemorin		 83.78
C00012177 Gallicin 83.78
C00012178 [3R-(3R*,3aS*,10E,11aS*)]-3a,5,6,8,9,11a-Hexahydro-3,10-dimethyl-6-methylene-cyclodeca[b]furan-2,7(3H,4H)-dione 83.78
C00012180 Herbolide H 83.78
C00012822 (1alpha,2beta,4aalpha,8aalpha)-Decahydro-1-isocyano-4a-methyl-8-methylene-2-(1-methylethyl)-naphthalene
6-Isocyano-4(15)-eudesmene		 83.78
C00012881 1-Deoxyivangustin
Alloalantolactone
[3aR-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 83.78
C00012885 (-)-Diplophyllin
Diplophyllin
[3aS-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 83.78
C00012886 [3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one 83.78
C00013031 (+)-Frullanolide
[3aR-(3aalpha,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 83.78
C00013548 Axamide 4
N-[2-Methyl-1-[(1R,3aR,7aR)-octahydro-3a-methyl-7-methylene-1H-inden-1-yl]-1-propenyl]-formamide		 83.78
C00013552 Axisothiocyanate 4
(1R,3aR,7aR)-Octahydro-1-(1-isothiocyanato-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 83.78
C00016474 Sulfinemycin 83.78
C00020134 gamma-Muurolen-15-oic acid 83.78
C00020191 12-Hydroxy-4,11(13)-cadinadien-15-oic acid 83.78
C00020193 12-Hydroxy-4-cadinen-15-oic acid 83.78
C00020390 Aciphyllic acid 83.78
C00020709 Osmitopsin 83.78
C00021019 3-Desoxo-achalensolide 83.78
C00021429 Mintsulfide 83.78
C00021670 Axisocyanate 3 83.78
C00021881 Hinokiic acid
Thujopsenic acid
Widdrenic acid		 83.78
C00021977 2-Isocyanopupukeanane 83.78
C00030480 6,10,14-Trimethyl-2-pentadecanone
Hexahydrofarnesyl acetone
6,10,14-Trimethylpentadecan-2-one
Perhydrofarnesyl acetone
Hexahydrofarnesy acetone		 83.78
C00031479 [(2E,4E)-Dodecadienoyl]-pyrrolidine 83.78
C00033138 Madolin A
(+)-Madolin A		 83.78
C00034362 11-epi-Gallicin 83.78
C00036303 (+)-Dihydrofrullanolide 83.78
C00036670 9beta-Acetoxyeudesma-4,11(13)-dien-12-oic acid 83.78
C00040487 Thujopsenol 83.78
C00042986 Scortechterpene A
(+)-Scortechterpene A		 83.78
C00042987 Scortechterpene B
(+)-Scortechterpene B		 83.78
C00046725 Durissimol A
(+)-Durissimol A		 83.78
C00047334 Phytone
(+)-Phytone		 83.78
C00048558 Teucmosin 83.78
C00050396 Pogostol O-methyl ether
(-)-Pogostol O-methyl ether		 83.78
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