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


and

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




INPUT WORD = C00011609 , 50% or more
[ Metabolite Name : alpha-Bisabol-1-one , 1-Bisabolone ]
Number of matched data : 61

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011640 Curlone
[S-(R*,R*)]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-hepten-4-one		 96.88
C00029679 alpha-Bisabolol
(-)-Bisabolol		 96.88
C00035098 epi-alpha-Bisabolol
(-)-epi-alpha-Bisabolol		 96.88
C00011600 [S-(R*,S*)]-6-(1,5-Dimethyl-3-oxo-4-hexenyl)-3-methyl-2-cyclohexen-1-one 94.12
C00011675 [4R-[4alpha,6alpha(S*)]]-6-(1,5-Dimethyl-4-hexenyl)-4-hydroxy-3-methyl-2-cyclohexen-1-one 94.12
C00011676 6-(1,5-Dimethyl-4-hexenyl)-6-hydroxy-3-methyl-2-cyclohexen-1-one 94.12
C00011680 [S-[R*,S*-(E)]]-2-Methyl-6-(4-methyl-2-oxo-3-cyclohexen-1-yl)-2-heptenal 94.12
C00011681 6-(1,5-Dimethyl-4-hexenyl)-3-(hydroxymethyl)-2-cyclohexen-1-one 94.12
C00032260 Sugikurojinol A
(4S)-2,6,10-Bisaboratrien-4-ol-1-one		 94.12
C00011606 beta-Bisabolol 93.75
C00011638 (-)-(E)-Lanceol 93.75
C00011642 (+)-alpha-Atlantone
(E)-alpha-Atlantone		 93.75
C00021903 trans-alpha-Bergamotene
(Z)-alpha-exo-bergamotol
(-)-exo-alpha-Bergamotene
(E)-alpha-Bergamotene
alpha-trans-Bergamotene
alpha-(E)-Bergamotene		 93.75
C00029970 cis-alpha-Bergamotene
alpha-cis-bergamotene		 93.75
C00003144 Hernandulcin 91.18
C00011599 [S-(R*,R*)]-alpha4-Methyl-alpha4-(4-methyl-3-pentenyl)-1-cyclohexene-1,4-dimethanol 91.18
C00011649 Ptilostemonol 91.18
C00016695 Cheimonophyllon B 91.18
C00021325 Vulgarone B 91.18
C00045807 Cubebenone
(+)-Cubebenone		 91.18
C00003199 beta-Vetivone 90.91
C00029348 (Z)-alpha-trans-Bergamotol 90.91
C00038074 (+)-Bisabola-2,10-diene[1,9]oxide 90.91
C00046525 Xenitorin B
(-)-Xenitorin B		 90.91
C00003103 (+)-alpha-Bisabolol 90.63
C00003111 alpha-Cedrene
Cedrene
Cedr-8-ene
(-)-Cedrene		 90.63
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene		 90.63
C00003132 trans,trans-Farnesol
Farnesol		 90.63
C00003203 alpha-Ylangene 90.63
C00011445 Dendrolasin 90.63
C00011499 Sesquirosefuran
Sesquirose furan
2-Geranyl-3-methylfuran		 90.63
C00011631 E-gamma-Bisabolene
(E)-4-(1,5-Dimethyl-4-hexenylidene)-1-methyl-cyclohexene
(E)-gamma-Bisabolene
trans-gamma-Bisabolene		 90.63
C00011646 (+)-beta-Atlantone
beta-Atlantone		 90.63
C00011893 [S-(R*,S*)]- 3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexen-1-one 90.63
C00011967 Sesquithujene 90.63
C00020043 Nephthene 90.63
C00021722 Di-epi-alpha-cedrene
alpha-Funebrene		 90.63
C00030246 Farnesal 90.63
C00035091 (E,E)-Farnesal
E,E-Farnesal
trans,trans-Farnesal		 90.63
C00035092 trans-Farnesol
E,E-Farnesol
(2E,6E)-Farnesol		 90.63
C00038319 7-epi-Sesquithujene 90.63
C00011588 Aminobisabolenol 88.24
C00011597 2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-6-heptene-2,3-diol 88.24
C00021723 alpha-Biotol 88.24
C00021870 Mustakone 88.24
C00035896 Vulgarol B 88.24
C00035967 7(14),10-bisaboladien-1-ol-4-one 88.24
C00043618 Isolemnalol
(-)-Isolemnalol		 88.24
C00003145 Himachalol 87.88
C00003191 Solavetivone 87.88
C00011918 Sesquicineole 87.88
C00011968 Sesquisabinene hydrate 87.88
C00011969 12-Sesquisabinenal
2-Methyl-6-(4-methylenebicyclo[3.1.0]hex-1-yl)-2-heptenal		 87.88
C00012817 Neoacolamone
Eudesm-4-en-6-one
(2S-cis)-3,4,4a,5,6,7-Hexahydro-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone		 87.88
C00017004 Isopetasan
Dehydrofukinone
3-Desoxyisopetasol		 87.88
C00020144 Isoepicubenol 87.88
C00020160 1,2,8,8a-Tetrahydro-4,6-dimethyl-1-(1-methylethyl)-2-naphthalenol 87.88
C00020407 Karatavin 87.88
C00021845 Campherenone 87.88
C00021901 4-Ambiguen-1-ol 87.88
C00038048 (-)-alpha-Alasken-6beta-ol 87.88
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