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


and

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





INPUT WORD = C00035098 , 50% or more
[ Metabolite Name : epi-alpha-Bisabolol , (-)-epi-alpha-Bisabolol ]
Number of matched data : 59

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029679 alpha-Bisabolol
(-)-Bisabolol
100.00
C00011609 alpha-Bisabol-1-one
1-Bisabolone
96.88
C00011640 Curlone
[S-(R*,R*)]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-hepten-4-one
96.88
C00011599 [S-(R*,R*)]-alpha4-Methyl-alpha4-(4-methyl-3-pentenyl)-1-cyclohexene-1,4-dimethanol 94.12
C00003103 (+)-alpha-Bisabolol 93.75
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
C00011600 [S-(R*,S*)]-6-(1,5-Dimethyl-3-oxo-4-hexenyl)-3-methyl-2-cyclohexen-1-one 91.18
C00011681 6-(1,5-Dimethyl-4-hexenyl)-3-(hydroxymethyl)-2-cyclohexen-1-one 91.18
C00011695 [R-(R*,R*)]-4-(1-Isocyano-1,5-dimethyl-4-hexenyl)-1-methyl-cyclohexene 91.18
C00021669 7-Isocyano-7,8-dihydro-a-bisabolene 91.18
C00011918 Sesquicineole 90.91
C00012738 (2R-cis)-1,2,3,4,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol 90.91
C00020407 Karatavin 90.91
C00029348 (Z)-alpha-trans-Bergamotol 90.91
C00035673 Lanceoloxide
(-)-Lanceoloxide
90.91
C00047290 Lignoren 90.91
C00003111 alpha-Cedrene
Cedrene
Cedr-8-ene
(-)-Cedrene
90.63
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene
90.63
C00003203 alpha-Ylangene 90.63
C00011586 [R-(R*,R*)]-alpha,4-Dimethyl-alpha-(4-methyl-3-pentenyl)-3-cyclohexene-1-methanamine 90.63
C00011587 Aminobisabolene
[S-(R*,S*)]-alpha,4-Dimethyl-alpha-(4-methyl-3-pentenyl)-3-cyclohexene-1-methanamine
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
C00011967 Sesquithujene 90.63
C00020043 Nephthene 90.63
C00021722 Di-epi-alpha-cedrene
alpha-Funebrene
90.63
C00038319 7-epi-Sesquithujene 90.63
C00003113 Centarol 88.57
C00011527 Cyclonerodiol 88.24
C00011588 Aminobisabolenol 88.24
C00011597 2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-6-heptene-2,3-diol 88.24
C00011675 [4R-[4alpha,6alpha(S*)]]-6-(1,5-Dimethyl-4-hexenyl)-4-hydroxy-3-methyl-2-cyclohexen-1-one 88.24
C00011676 6-(1,5-Dimethyl-4-hexenyl)-6-hydroxy-3-methyl-2-cyclohexen-1-one 88.24
C00011678 Delobanone
[R-(R*,S*)]-5-(1-Hydroxy-1,5-dimethyl-4-hexenyl)-2-methyl-2-cyclohexen-1-one
88.24
C00011680 [S-[R*,S*-(E)]]-2-Methyl-6-(4-methyl-2-oxo-3-cyclohexen-1-yl)-2-heptenal 88.24
C00020096 9,10-Epoxy-4-muurolene 88.24
C00021723 alpha-Biotol 88.24
C00022800 7,15-Dihydroxybisabol-10-ene 88.24
C00045807 Cubebenone
(+)-Cubebenone
88.24
C00011405 3,7,11-Trimethyl-1,10-dodecadiene-3,7-diol 87.88
C00011427 3,7,11-Trimethyl-1,5,10-dodecatriene-3,7-diol 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
C00012736 Ent-8beta-hydroxyeudesma-3,11-diene
[2S-(2alpha,3alpha,4abeta,8aalpha)]-1,2,3,4,4a,7,8,8a-Octahydro-5,8a,dimethyl-3-(1-methylethenyl)-2-naphthalenol
87.88
C00020144 Isoepicubenol 87.88
C00020150 (-)-delta-Cadinol
delta-Cadinol
(-)-Torreyol
Torreyol
Cedreanol
Sesquigoyol
87.88
C00020154 tau-Muurolol
epi-alpha-Muurolol
T-Muurolol
87.88
C00020398 1beta,10betaH-Guaia-4,11-dien-3-one 87.88
C00021845 Campherenone 87.88
C00022791 1alpha,7alpha,10alphaH-Guaia-4,11(13)-dien-3-one 87.88
C00037106 ent-T-muurolol 87.88
C00038054 (-)-Eudesm-7(11)-en-4alpha-ol
Juniper camphor
87.88
C00038074 (+)-Bisabola-2,10-diene[1,9]oxide 87.88
C00040747 (+)-T-cadinol 87.88
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