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


and

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




INPUT WORD = C00021211 , 50% or more
[ Metabolite Name : 1-Isothiocyanatoaromadendrane ]
Number of matched data : 102

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021243 10alpha-Isothiocyanatoalloaromadendrane 97.37
C00021244 Axisothiocyanate 2 97.37
C00013576 Epipolasin A
(1aR,3aS,7S,7aS,7bR)-Decahydro-7-isothiocyanato-1,1,3a,7-tetramethyl-1H-cyclopropa[a]naphthalene		 94.74
C00021241 Axamide 2 94.74
C00021245 Epipolasin B 94.74
C00013577 (-)-Epipolasin A 92.11
C00021664 10-Isothiocyanatoguai-6-ene 92.11
C00021666 Acanthene B 92.11
C00049930 2-(Formylamino)trachyopsane
(-)-2-(Formylamino)trachyopsane		 92.11
C00011725 [1S-(1R*,5E,7R*)]-4,10-bis(methylene)-7-(1-methylethyl)-5-Cyclodecen-1-ol acetate 89.47
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 89.47
C00020115 1-Isothiocyanato-4-muurolene 89.47
C00021210 1-Isocyanoaromadendrane 89.47
C00021242 Axisonitrile 2 89.47
C00021427 6-Isodaucene 14-isothiocyanate 89.47
C00021645 Acanthisothiocyanate 3 89.47
C00038557 Axinisothiocyanate J
(+)-Axinisothiocyanate J		 87.18
C00038560 Axinisothiocyanate M
(-)-Axinisothiocyanate M		 87.18
C00048623 Axiplyn C
(+)-Axiplyn C		 87.18
C00012429 (-)-1,10-Epoxy-14-hydroperoxy-4-lepidozene
1,10-Epoxy-14-hydroperoxy-4-lepidozene		 86.84
C00012436 (-)-1,10-Epoxy-5-hydroperoxy-4(14)-lepidozene
1,10-Epoxy-5-hydroperoxy-4(14)-lepidozene		 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		 86.84
C00013549 Axisothiocyanate 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isothiocyanato-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 86.84
C00021209 allo-Aromadendrane-10beta,14-diol 86.84
C00021212 Palustrol 86.84
C00021238 Hydroxyalloaromadendrene 86.84
C00021665 10-Isothiocyanato-4-cadinene 86.84
C00021668 (1R,6S,7S,10S)-10-Isothiocyanato-4-amorphene
10-Isothiocyanato-4-amorphene		 86.84
C00029488 3beta-Chlorodehydrocostuslactone 86.84
C00033303 Pipelol A
(-)-Pipelol A		 86.84
C00038558 Axinisothiocyanate K
(+)-Axinisothiocyanate K		 86.84
C00039330 Halichonadin F
(+)-Halichonadin F		 86.84
C00048594 7-epi-Neoptilocaulin
(+)-7-epi-Neoptilocaulin		 86.84
C00050396 Pogostol O-methyl ether
(-)-Pogostol O-methyl ether		 86.84
C00038561 Axinisothiocyanate N
(-)-Axinisothiocyanate N		 85.37
C00021281 (-)-Cyperenyl acetate 85.00
C00038559 Axinisothiocyanate L
(-)-Axinisothiocyanate L		 84.62
C00000149 Espatulenol
(+)-Spathulenol
Spathulenol		 84.21
C00001954 Phlegmarine
(-)-Phlegmarine		 84.21
C00002032 Cryptophorine 84.21
C00002224 Leontiformine 84.21
C00003237 Confertin 84.21
C00003245 Dehydrocostus lactone 84.21
C00003397 Zaluzanin C 84.21
C00007756 Virgiboidine 84.21
C00011920 Theonellin formamide 84.21
C00011922 Theonellin isothiocyanate 84.21
C00012434 (-)-1,10-Epoxy-4(14)-lepidozen-5-ol
1,10-Epoxy-4(14)-lepidozen-5-ol		 84.21
C00012498 Decahydro-7,7,9a-trimethyl-4-methylene-6H-Oxireno[5,6]cyclonona[1,2-b]furan-6-one
Epoxypavinolide		 84.21
C00012822 (1alpha,2beta,4aalpha,8aalpha)-Decahydro-1-isocyano-4a-methyl-8-methylene-2-(1-methylethyl)-naphthalene
6-Isocyano-4(15)-eudesmene		 84.21
C00013548 Axamide 4
N-[2-Methyl-1-[(1R,3aR,7aR)-octahydro-3a-methyl-7-methylene-1H-inden-1-yl]-1-propenyl]-formamide		 84.21
C00013552 Axisothiocyanate 4
(1R,3aR,7aR)-Octahydro-1-(1-isothiocyanato-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 84.21
C00016474 Sulfinemycin 84.21
C00020378 Epoxyguaiene
1alpha,5alpha-Epoxy-alpha-guaiene		 84.21
C00020641 1beta-Hydroperoxy-4(15),5E,10(14)-germacratriene 84.21
C00020722 4alpha-Hydroxyguaia-10(14),11(13)-dien-12,6a-olide 84.21
C00020723 Compressanolide 84.21
C00020728 Trifloculoside 84.21
C00020799 Involucratolactone
8alpha-Hydroxy-11,13-dihydrodehydrocostuslactone		 84.21
C00020914 Elehirtanolide 84.21
C00020922 10alpha,14H-1-epi-Inuviscolide 84.21
C00020934 1-EpiInuviscolide 84.21
C00020935 Inuviscolide 84.21
C00020937 8-Epiinuviscolide 84.21
C00020938 4,8-Dipiinuviscolide 84.21
C00020996 [3aR-(3aalpha,4aalpha,6beta,7aalpha,9abeta)]-Decahydro-6-hydroxy-3,5,8-tris(methylene)-azuleno[6,5-b]furan-2(3H)-one 84.21
C00020998 [3aR-(3aalpha,4aalpha,7aalpha,9abeta)]-Octahydro-3,5,8-tris(methylene)-azuleno[6,5-b]furan-2,6(3H,4H)-dione 84.21
C00020999 11beta,13-Dihydrozaluzanin C 84.21
C00021000 3-3-Epizaluzanin C 84.21
C00021008 11alpha,13-Dihydrozaluzanin C 84.21
C00021009 4beta,14-Dihydrozaluzanin C 84.21
C00021137 [3S-(3alpha,3aalpha,5alpha,8alpha,8abeta)]-Decahydro-3-hydroxy-3a,8-dimethyl-a-methylene 5-azuleneacetic acid 84.21
C00021140 Dihydroconfertin 84.21
C00021207 Alloaromadendrane-4alpha,10beta-diol 84.21
C00021208 Flourensadiol 84.21
C00021230 (+)-Aromadendrene
Aromadendrene
(+)-Aromadendr-7(15)-ene		 84.21
C00021231 8alpha-Hydroxyspathulenol 84.21
C00021234 Sesquivarodiol 84.21
C00021248 (-)-Myliol
Myliol		 84.21
C00021253 Plagiochilal A
Hanegokedial		 84.21
C00021261 Plagiochilide 84.21
C00021274 (-)-Methyl asperageigerate 84.21
C00021667 7-Isothiocyanato-7,8-dihydro-alpha-bisabolene 84.21
C00021670 Axisocyanate 3 84.21
C00021977 2-Isocyanopupukeanane 84.21
C00021978 9-Isocyanopupukeanane 84.21
C00021979 9-epi-9-Isocyanopupukeanane 84.21
C00022011 3,7-Epoxycaryophyllane-5alpha,15-diol 84.21
C00023427 (-)-Sclareolide
ent-Norambreinolide		 84.21
C00029669 alpha-Guaiol 84.21
C00030480 6,10,14-Trimethyl-2-pentadecanone
Hexahydrofarnesyl acetone
6,10,14-Trimethylpentadecan-2-one
Perhydrofarnesyl acetone
Hexahydrofarnesy acetone		 84.21
C00031765 (-)-ent-Spathulenol
beta-Spathulenol
ent-Spathulenol
(-)-Spathulenol		 84.21
C00033797 Dysodensiol F
(+)-Dysodensiol F		 84.21
C00035945 4(15)-Aromadendren-12,5alpha-olide
(+)-4(15)-Aromadendren-12,5alpha-olide		 84.21
C00036326 (1R,10R)-Aromadendran-9-one 84.21
C00036333 (1S,10S)-9alpha-Hydroxy-allo-aromadendrane 84.21
C00036334 (1S,10S)-allo-Aromadendran-9-one 84.21
C00036349 (4S*,5S*,6R*,7R*)-5-Methoxy-1(10)E-lepidozene 84.21
C00037100 ent-3beta-Hydroxyspathulenol 84.21
C00042837 Peroxygibberol
(+)-Peroxygibberol		 84.21
C00042870 Ptilocaulin 84.21
C00042986 Scortechterpene A
(+)-Scortechterpene A		 84.21
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