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


and

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





INPUT WORD = C00046525 , 50% or more
[ Metabolite Name : Xenitorin B , (-)-Xenitorin B ]
Number of matched data : 95

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00046528 Xenitorin E
(-)-Xenitorin E
94.29
C00046529 Xenitorin F
(-)-Xenitorin F
94.29
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
93.94
C00021902 Bazzanenol 93.94
C00046524 Xenitorin A
(-)-Xenitorin A
93.94
C00046526 Xenitorin C
(-)-Xenitorin C
93.94
C00021866 alpha-Copaen-11-ol 91.18
C00031766 epi-Cubebol
Epicubebol
4-epi-Cubebol
91.18
C00011556 [R-(Z,E)]-5-(2,2-Dimethyl-6-methylenecyclohexyl)-3-methyl-2,4-pentadien-1-ol 90.91
C00011557 gamma-Monocyclofarnesol
trans-gamma-Monocyclofarnesol
90.91
C00011609 alpha-Bisabol-1-one
1-Bisabolone
90.91
C00011709 Acoragermacrone 90.91
C00012007 Isoshyobunone
iso-Shyobunone
(1S,4S)-2-Isopropylidene-1-vinyl-p-menthan-3-one
90.91
C00012808 beta-Verbesinol
[1R-(1alpha,2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenol
90.91
C00020052 gamma1-Cadinene 90.91
C00020066 epi-alpha-Cadinol
T-Cadinol
tau-Cadinol,T-Cadinol
tau-Cadinol
90.91
C00020250 alpha-Oplopenone 90.91
C00020251 10(14)-Oplopen-3-one 90.91
C00020739 [3aR-(1E,3aalpha,7beta,7abeta)]-1-Ethylideneoctahydro-4-methylene-7-(1-methylethyl)-2H-inden-2-one 90.91
C00021611 Laurencenone C 90.91
C00038069 (+)-7-epi-Junenol 90.91
C00012818 (2R-trans)-3,4,4a,5,6,7-Hexahydro-2-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone
7alpha-Hydroxyneoacolamone
88.57
C00035842 iso-Acorone 88.57
C00047877 Fetidone B
(+)-Fetidone B
88.57
C00011545 (E)-(+)-2-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-2-butenedial 88.24
C00011681 6-(1,5-Dimethyl-4-hexenyl)-3-(hydroxymethyl)-2-cyclohexen-1-one 88.24
C00011696 (-)-Tovarol
Tovarol
[1S-(1R*,2S*,3R*,4E,8E)]-5,9-Dimethyl-2-(1-methylethyl)-4,8-cyclodecadiene-1,3-diol
88.24
C00011699 (-)-Puliglene
beta-Pulignene
Puliglene
88.24
C00011898 Dihydropseudotsugonol 88.24
C00011899 Dihydropseudotsugonal 88.24
C00020095 4,10-Epoxymuurolane 88.24
C00021272 Cubebol
Cubeb camphor
(-)-Cubebol
88.24
C00021862 Copaborneol 88.24
C00021863 Copacamphor 88.24
C00021868 cis-alpha-Copaene-8-ol
alpha-Copaen-8-ol
88.24
C00021869 alpha-Copaen-8-one 88.24
C00021965 Acanthodoral 88.24
C00046150 Millecrone B 88.24
C00000164 (+)-beta-Eudesmol
beta-Eudesmol
87.88
C00003121 beta-Cubebene 87.88
C00011395 (E,E)-(-)-10-hydroxy-2,6,10-trimethyl-2,5,7,11-Dodecatetraen-4-one 87.88
C00011448 (E,E,E)-3-(4,8-Dimethyl-2,4,6-nonatrienyl)-furan
(2E,4E,6E)-Dehydrodendrolasin
Dehydrodendrolasin
87.88
C00011645 (Z)-6-Methyl-2-(4-methyl-3-cyclohexen-1-yl)-2-hepten-4-one 87.88
C00011710 Hedycaryol 87.88
C00011714 Preisocalamendiol
Preisocalamenediol
87.88
C00011893 [S-(R*,S*)]- 3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexen-1-one 87.88
C00011957 (-)-Penlanfuran
Penlanfuran
87.88
C00012003 Shyobunon
Shyobunone
87.88
C00012004 Epishyobunone 87.88
C00012805 (+)-Junenol
Eudesm-4(14)-en-6alpha-ol
[1S-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenol
87.88
C00012806 Acolamone
[2S-(2alpha,4aalpha,8abeta)]-Octahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1(2H)-naphthalenone
87.88
C00012807 Laevojunenol
Levojuneno
l-Junenol
[1R-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenol
87.88
C00012812 Isointermedeol 87.88
C00012813 Kongol
Selin-11-en-4alpha-ol
5alpha,7alphaH-Eudesm-11(13)en-4alpha-ol
[1R-(1alpha,4abeta,7beta,8aalpha)]-decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol
87.88
C00012814 Amiteol
[1R-(1alpha,4abeta,7beta,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol
87.88
C00012815 neo-Intermedeol
(-)-Neointermedeol
Neointermedeol
[1S-(1alpha,4aalpha,7alpha,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol
87.88
C00012816 (+)-Intermedeol
5beta,10alpha-Eudesm-11-en-4-ol
Intermedeol
87.88
C00013217 Chamaecynone
Chamecynone
[1S-(1alpha,4abeta,7beta,8abeta)]-7-Ethynyl-4a,5,6,7,8,8a-hexahydro-1,4a-dimethyl-2(1H)-naphthalenone
87.88
C00013218 Isochamaecynone
[1R-(1alpha,4aalpha,7alpha,8aalpha)]-7-ethynyl-4a,5,6,7,8,8a-Hexahydro-1,4a-dimethyl-2(1H)-naphthalenone
87.88
C00016991 Alloeremophilone
3-Desoxyneopetasol
Eremophila-9,11-dien-8-one
Neopetasan
87.88
C00017004 Isopetasan
Dehydrofukinone
3-Desoxyisopetasol
87.88
C00020041 beta1-Bulgarene
4,9-Bulgaradiene
87.88
C00020044 (-)-epsilon-Bulgarene 87.88
C00020051 alpha-Cadinene 87.88
C00020058 Khusinol
1beta,6alpha,7betaH-Cadina-4,10(15)-dien-2beta-ol
87.88
C00020065 (-)-alpha-Cadinol
alpha-Cadinol
Cadin-4-en-10-ol
87.88
C00020128 Sclerosporal
14-Oxy-alpha-muurolene
87.88
C00020249 4,10(14)-Oplopadien-3-ol 87.88
C00020252 beta-Oploplenone
beta-Oplopenone
Oplopenone
87.88
C00020384 6,9-Guaiadiene 87.88
C00020410 Pogostol 87.88
C00020738 [3aR-(1Z,3aalpha,7beta,7abeta)]-1-Ethylideneoctahydro-4-methylene-7-(1-methylethyl)-2H-inden-2-one 87.88
C00021228 9-Aromadendrene 87.88
C00021229 allo-Aromadendrene
L-Alloaromadendrene
Alloaromadendrene
87.88
C00021285 3-Isopatchoulene 87.88
C00021428 Salvial-4(14)-en-1-one
Mintketone
87.88
C00021637 Majusculone 87.88
C00021717 Spirojatamol 87.88
C00021859 (+)-Cyclosativene
Cyclosativene
87.88
C00021864 Sinularene 87.88
C00021880 Thujopsadiene 87.88
C00029395 14-Hydroxy-alpha-humulene 87.88
C00029671 alpha-Muurolene 87.88
C00030525 Isofaurinone 87.88
C00033660 beta-Ylangene 87.88
C00034387 3,9-Dimethyl-6-isopropyl-2E,7E,9-decatrienal 87.88
C00034905 CID is old! 87.88
C00035184 (+)-alpha-Cadinol 87.88
C00035800 allo-Aromadendr-9-ene
9-Alloaromadendrene
87.88
C00036402 11-Hydroxyguaia-4,6-diene
trans-11-Hydroxyguaia-4,6-diene
87.88
C00036710 alpha-Copane 87.88
C00044033 (+)-beta-Copaene 87.88
C00046149 Millecrone A 87.88
C00048329 beta-Copaene 87.88
C00049072 1-Himachalen-4beta-ol
(+)-1-Himachalen-4beta-ol
87.88
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