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


and

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




INPUT WORD = C00021667 , 50% or more
[ Metabolite Name : 7-Isothiocyanato-7,8-dihydro-alpha-bisabolene ]
Number of matched data : 60

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021665 10-Isothiocyanato-4-cadinene 94.59
C00021668 (1R,6S,7S,10S)-10-Isothiocyanato-4-amorphene
10-Isothiocyanato-4-amorphene		 94.59
C00038558 Axinisothiocyanate K
(+)-Axinisothiocyanate K		 94.59
C00048620 Axinythiocyanate A
(+)-Axinythiocyanate A		 94.44
C00020115 1-Isothiocyanato-4-muurolene 91.89
C00038559 Axinisothiocyanate L
(-)-Axinisothiocyanate L		 89.74
C00021664 10-Isothiocyanatoguai-6-ene 89.19
C00011586 [R-(R*,R*)]-alpha,4-Dimethyl-alpha-(4-methyl-3-pentenyl)-3-cyclohexene-1-methanamine 88.89
C00011587 Aminobisabolene
[S-(R*,S*)]-alpha,4-Dimethyl-alpha-(4-methyl-3-pentenyl)-3-cyclohexene-1-methanamine		 88.89
C00011694 [R-(R*,R*)]-4-(1-Isocyanato-1,5-dimethyl-4-hexenyl)-1-methyl-cyclohexene 88.89
C00021243 10alpha-Isothiocyanatoalloaromadendrane 86.84
C00021244 Axisothiocyanate 2 86.84
C00003103 (+)-alpha-Bisabolol 86.11
C00011695 [R-(R*,R*)]-4-(1-Isocyano-1,5-dimethyl-4-hexenyl)-1-methyl-cyclohexene 86.11
C00021669 7-Isocyano-7,8-dihydro-a-bisabolene 86.11
C00013576 Epipolasin A
(1aR,3aS,7S,7aS,7bR)-Decahydro-7-isothiocyanato-1,1,3a,7-tetramethyl-1H-cyclopropa[a]naphthalene		 84.21
C00021211 1-Isothiocyanatoaromadendrane 84.21
C00021241 Axamide 2 84.21
C00021245 Epipolasin B 84.21
C00016474 Sulfinemycin 83.78
C00021666 Acanthene B 83.78
C00042987 Scortechterpene B
(+)-Scortechterpene B		 83.78
C00044095 Artemisinic acid methyl ester 83.78
C00003144 Hernandulcin 83.33
C00003292 Glechomanolide 83.33
C00007242 (S)-beta-Bisabolene
beta-Bisabolene
(-)-beta-Bisabolene
l-beta-Bisabolene
1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)cyclohexene		 83.33
C00010853 [1R-[1a(Z),6b]]-2-Methyl-3-methyl-6-(1-methylethyl)-2-oxo-3-cyclohexen-1-yl ester 83.33
C00011589 (+)-Isoaminobisabolenol b
Isoaminobisabolenol b		 83.33
C00011590 (+)-Isoaminobisabolenol a
Isoaminobisabolenol a		 83.33
C00011646 (+)-beta-Atlantone
beta-Atlantone		 83.33
C00011677 [R-(R*,S*)]-6-Hydroxy-2-methyl-6-(4-methyl-3-cyclohexen-1-yl)-2-hepten-4-one 83.33
C00011678 Delobanone
[R-(R*,S*)]-5-(1-Hydroxy-1,5-dimethyl-4-hexenyl)-2-methyl-2-cyclohexen-1-one		 83.33
C00011689 [R-(E)]-6-(4-Formyl-3-cyclohexen-1-yl)-2-methyl-2,6-heptadienoic acid 83.33
C00011904 (+)-Epitodomatuic acid
Epitodomatuic acid		 83.33
C00011920 Theonellin formamide 83.33
C00011922 Theonellin isothiocyanate 83.33
C00011965 Sesquicarene
[1R-(1a,6a,7a)]-3,7-Dimethyl-7-(4-methyl-3-pentenyl)-bicyclo[4.1.0]hept-2-ene		 83.33
C00012379 [3R-(3R*,3aR*,5E,9E,11aS*)]-3a,4,7,8,11,11a-Hexahydro-3,6,10-trimethylcyclodeca[b]furan-2(3H)-one 83.33
C00012380 Inunolide 83.33
C00012381 Dihydroinunolide
[3S-(3R*,3aS*,5E,9E,11aS*)]-3a,4,7,8,11,11a-hexahydro-3,6,10-trimethylcyclodeca[b]furan-2(3H)-one		 83.33
C00017521 Arteannuic acid
Artemisic acid
Artemisinic acid
Artemisininic acid
Qing Hau acid		 83.33
C00020150 delta-Cadinol
(-)-Torreyol
Torreyol
Cedreanol
Sesquigoyol		 83.33
C00020154 tau-Muurolol
epi-alpha-Muurolol
T-Muurolol		 83.33
C00020155 Pernetic acid B 83.33
C00020224 9-Oxo-10,11-dehydroageraphorone 83.33
C00021242 Axisonitrile 2 83.33
C00021317 2-Himachalene-7,12-diol 83.33
C00021599 4-Chloro-3,7(14)-chamigradien-9-ol 83.33
C00030130 Dihydroartemisinic acid
(-)-Dihydroartemisinic acid		 83.33
C00034498 Engelhardic acid 83.33
C00034802 Bisabolol oxide B 83.33
C00035439 (S)-(Z)-Lanceol
Z-lanceol
cis-Lanceol		 83.33
C00037033 Deoxyarteannuin B
Deoxyisoartemisinin C		 83.33
C00037054 Dihydrodeoxyarteannuin B 83.33
C00037106 ent-T-muurolol 83.33
C00037269 Palmitic amide
Hexadecanamide		 83.33
C00038074 (+)-Bisabola-2,10-diene[1,9]oxide 83.33
C00038117 10alpha,11-Dihydroxyamorph-4-ene 83.33
C00040747 (+)-T-cadinol 83.33
C00042021 (Z)-Lanceol 83.33
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