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


and

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





INPUT WORD = C00029348 , 50% or more
[ Metabolite Name : (Z)-alpha-trans-Bergamotol ]
Number of matched data : 101

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011628 [S-[R*,S*-(E)]]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-heptenal 96.97
C00011680 [S-[R*,S*-(E)]]-2-Methyl-6-(4-methyl-2-oxo-3-cyclohexen-1-yl)-2-heptenal 94.12
C00011606 beta-Bisabolol 93.94
C00011969 12-Sesquisabinenal
2-Methyl-6-(4-methylenebicyclo[3.1.0]hex-1-yl)-2-heptenal
93.94
C00012737 alpha-Costol
(-)-alpha-Costol
[2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-beta-methylene-2-naphthaleneethanol
93.94
C00021903 trans-alpha-Bergamotene
(Z)-alpha-exo-bergamotol
(-)-exo-alpha-Bergamotene
(E)-alpha-Bergamotene
alpha-trans-Bergamotene
alpha-(E)-Bergamotene
93.94
C00029970 cis-alpha-Bergamotene
alpha-cis-bergamotene
93.94
C00048311 alpha-Bergamotene 93.94
C00047214 Dihydroxybergamotene 91.43
C00011649 Ptilostemonol 91.18
C00011675 [4R-[4alpha,6alpha(S*)]]-6-(1,5-Dimethyl-4-hexenyl)-4-hydroxy-3-methyl-2-cyclohexen-1-one 91.18
C00011676 6-(1,5-Dimethyl-4-hexenyl)-6-hydroxy-3-methyl-2-cyclohexen-1-one 91.18
C00021323 Marsupellone 91.18
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene
90.91
C00003183 beta-Santalol
(E)-beta-Santalol
90.91
C00003199 beta-Vetivone 90.91
C00003203 alpha-Ylangene 90.91
C00007630 beta-Sesquiphellandrene 90.91
C00011609 alpha-Bisabol-1-one
1-Bisabolone
90.91
C00011640 Curlone
[S-(R*,R*)]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-hepten-4-one
90.91
C00012488 Buddledin C 90.91
C00012489 Buddledin D 90.91
C00012738 (2R-cis)-1,2,3,4,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol 90.91
C00012755 (4aR-cis)-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethylidene)-2(1H)-naphthalenone 90.91
C00020144 Isoepicubenol 90.91
C00021857 (E)-beta-Santalal 90.91
C00021865 Copadiene 90.91
C00029679 alpha-Bisabolol
(-)-Bisabolol
90.91
C00035098 epi-alpha-Bisabolol
(-)-epi-alpha-Bisabolol
90.91
C00035439 cis-Lanceol
(S)-(Z)-Lanceol
Z-lanceol
90.91
C00036277 (-)-Eudesma-3,11-dien-5-ol 90.91
C00042021 (Z)-Lanceol 90.91
C00012724 alpha-Costic acid
Eudesma-3,11(13)-dien-12-oic acid
[2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid
88.57
C00003182 cis-alpha-Santalol
alpha-Santalol
88.24
C00011521 Chokol C
(-)-Chokol C
88.24
C00011522 Chokol D
(-)-Chokol D
88.24
C00011597 2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-6-heptene-2,3-diol 88.24
C00011599 [S-(R*,R*)]-alpha4-Methyl-alpha4-(4-methyl-3-pentenyl)-1-cyclohexene-1,4-dimethanol 88.24
C00011600 [S-(R*,S*)]-6-(1,5-Dimethyl-3-oxo-4-hexenyl)-3-methyl-2-cyclohexen-1-one 88.24
C00011681 6-(1,5-Dimethyl-4-hexenyl)-3-(hydroxymethyl)-2-cyclohexen-1-one 88.24
C00021321 4-Longipinanone 88.24
C00021325 Vulgarone B 88.24
C00021853 (E)-alpha-Santalal
alpha-Santal-10-en-12-al
88.24
C00021854 alpha-Santalone 88.24
C00021985 Myltaylenol
(-)-Myltaylenol
88.24
C00037527 CID is old! 88.24
C00038163 14-Hydroxymodhephene
(-)-14-Hydroxymodhephene
88.24
C00042019 (Z)-1beta-hydroxy-2-hydrolanceol 88.24
C00003188 alpha-Sinensal 87.88
C00003191 Solavetivone 87.88
C00011568 Pallescensin 1 87.88
C00011569 Pallescensin 2 87.88
C00011642 (+)-alpha-Atlantone
(E)-alpha-Atlantone
87.88
C00011647 (-)-Cryptomerione
(R)-Cryptomerione
87.88
C00011967 Sesquithujene 87.88
C00011968 Sesquisabinene hydrate 87.88
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al
87.88
C00012478 Caryophyllenol I 87.88
C00012479 Caryophyllenol II 87.88
C00012480 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 87.88
C00012481 [1S-(1R*,2R*,5E,9S*)]-6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 87.88
C00012709 (-)-alpha-Helmiscapene
alpha-Helmiscapene
[2S-(2a,4ab,8ab)]-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene
87.88
C00012710 5beta,10alpha-Eudesma-3,11-diene 87.88
C00012711 [2R-(2alpha,4aalpha,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene 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
C00012745 Selina-4(14),7(11)-diene-9-ol
[1S-(1alpha,4abeta,8aalpha)]-Decahydro-8a-methyl-5-methylene-3-(1-methylethylidene)-1-naphthalenol
87.88
C00012749 (+)-beta-Costol
(+)-Costol
beta-Costol
Sesquibenihiol
Eudesma-4(14),11(13)-dien-12-ol
[2R-(2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol
87.88
C00012750 (+)-Costal
Costic aldehyde
(+)-beta-Costal
Eudesma-4(14),11(13)-dien-12-al
87.88
C00012756 [4aR-(4aalpha,6beta,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 87.88
C00012757 [4aS-(4aalpha,6alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 87.88
C00012758 [4aS-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 87.88
C00012801 alpha-Verbesinol
[1R-(1alph,2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenol
87.88
C00012802 Isoacolamone
[2S-(2alpha,4aalpha,8abeta)]-3,4,4a,5,6,8a-Hexahydro-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone
87.88
C00012803 7-epi-alpha-Eudesmol
[2S-(2alpha,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol
87.88
C00016985 (+)-Isovalencenol
Isovalencenol
87.88
C00020043 Nephthene 87.88
C00021296 10-Epivalerenol 87.88
C00021476 1-Sterpurene 87.88
C00021779 Dactylol 87.88
C00021834 alpha-Panasinsene
alpha-Panasinsanene
87.88
C00021845 Campherenone 87.88
C00021883 alpha-Bourbonene 87.88
C00021904 trans-beta-Bergamotene 87.88
C00021952 Isowiddrene
alpha-Pseudowiddrene
87.88
C00029672 (-)-alpha-Selinene
alpha-Selinene
87.88
C00029678 alpha-Maaliene 87.88
C00030189 epi-alpha-Selinene 87.88
C00032374 Artemisinic alcohol
trans-Arteannuic alcohol
87.88
C00035441 (Z)-gamma-Bisabolene 87.88
C00035993 (+)-Eudesma-3,7(11)-dien-8-one 87.88
C00036276 (-)-Eudesma-2,4(15)-11-triene 87.88
C00036298 (+)-alpha-Selinene 87.88
C00036714 alpha-Longipinene
(+)-alpha-Longipinene
87.88
C00037125 Eudesm-4(15)-en-7-ol
(+)-Eudesm-4(15)-en-7alpha-ol
87.88
C00038047 (-)-7-epi-Isojunenol 87.88
C00038319 7-epi-Sesquithujene 87.88
C00040179 Rupestrenol
(+)-Rupestrenol
87.88
C00044031 (+)-alpha-Copaene 87.88
C00046204 Neocuprenenol
(+)-Neocuprenenol
87.88
C00046584 4,5-Dihydro-beta-caryophyllene-14-al
(-)-4,5-Dihydro-beta-caryophyllene-14-al
87.88
C00048297 7-epi-alpha-Selinene 87.88
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