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


and

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





INPUT WORD = C00012470 , 50% or more
[ Metabolite Name : (E,E)-4,4,8-Trimethyl-2,8-cycloundecadien-1-one , Rudbeckianone ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012423 (-)-Noranthoplone
Noranthoplone
96.67
C00012454 gamma-Humulene
Isohumulene
96.67
C00003110 beta-Caryophyllene
(E)-beta-Caryophyllene
caryophyllene
Caryophyllene
(E)-Caryophyllene
(-)-(E)-Caryophyllene
trans-Caryophyllene
trans-beta-Caryophyllene
93.55
C00011421 Fokienol
(E,E)-3,7,11-trimethyl-1,6,9,11-Dodecatetraen-3-ol
93.55
C00012471 (+)-9-epi-beta-Caryophyllene
9-epi-(E)-Caryophyllene
93.55
C00012474 Isocaryophyllene
(-)-Isocaryophyllene
(Z)-Caryophyllene
gamma-Caryophyllen
cis-Caryophyllene
93.55
C00044032 (+)-beta-Caryophyllene 93.55
C00003147 alpha-Caryophyllene (obsol.)
alpha-Caryophyllene
alpha-Humulene
Humulene
(+/-)-alpha-Humulene
93.33
C00011507 (E)-6,10-Dimethyl-9-methylene-5-undecen-2-one 93.33
C00012443 Humulene epoxide
Humulene oxide
alpha-Humulene oxide
Humulene I epoxide
Humulene epoxide I
Humulene monoxide
Humulene oxide I
90.91
C00011711 [1R-(1R*,2E,4R*,7E)]-1,7-Dimethyl-4-(1-methylethyl)-2,7-cyclodecadien-1-ol 90.63
C00011713 (-)-1(10)E,5E-Germacradien-4-ol
[1S-(1R*,2E,4R*,7E)]-1,7-Dimethyl-4-(1-methylethyl)-2,7-cyclodecadien-1-ol
(-)-1(10),5-Germacradien-4-ol
90.63
C00012464 (+)-Humulenol I
Humulenol I
90.63
C00012465 (E,E)-2,9,9-Trimethyl-6-methylene-2,7-cycloundecadien-1-one
gamma-Humulen-9-one
90.63
C00021459 delta6-Protoilludene 90.63
C00030187 (-)-Ledene
ent-Ledene
(-)-Leden
90.63
C00003166 Nerolidol 90.32
C00011420 (E,E)-3,7,11,-Trimethyl-1,4,6,10-tetraen-3-ol
Brickelliol
90.32
C00012425 (+)-Bicyclogermacrene
Bicyclogermacren
Bicyclogermacrene
Biclyclogermacrene
90.32
C00013215 Dehydrochamecynenol
(-)-Dehydrochamecynenol
[4aS-(4aalpha,7alpha,8aalpha)]-7-Ethynyl-4a,5,6,7,8,8a-hexahydro-4a-methyl-1-naphthalenemethanol
90.32
C00020380 Sclerosporene 90.32
C00021308 beta-Himachalene 90.32
C00029339 (6E)-3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol
(E)-Nerolidol
E-Nerolidol
trans-Nerolidol
90.32
C00034757 cis-Nerolidol
(Z)-Nerolidol
90.32
C00036272 (-)-Bicyclogermacrene
ent-Bicyclogermacrene
90.32
C00037322 Isobicyclogermacrene
(+)-Isobicyclogermacrene
90.32
C00003131 E-beta-farnesene
trans-beta-Farnesene
(E)-beta-Farnesene
beta-Farnesene
(E)-beta-Famesene
beta-trans-Farnesene
90.00
C00010295 3,7-Dimethyl-2,5-octadiene-1,7-diol 90.00
C00011411 2,6,10-Trimethyldodecane
Farnesane
90.00
C00012455 beta-Humulene 90.00
C00029350 cis-beta-Farnesene
(Z)-Farnesene
(Z)-beta-Farnesene
beta-cis-Farnesene
Z-beta-Farnesene
90.00
C00045563 3-Hydroxy-beta-ionone 90.00
C00048434 Isogermacrene D
(-)-Isogermacrene D
90.00
C00012473 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethyl-spiro[bicyclo[7.2.0]undec-5-ene-2,2'-oxirane]
3',15-Epoxy-6-caryophyllene
88.24
C00011426 2,6,10-Trimethyl-3,6,11-dodecatriene-2,10-diol 87.88
C00011551 Bicyclolaurencenol 87.88
C00011929 (+)-Cabreuva oxide A
Cabreuva oxide A
87.88
C00011931 (-)-Cabreuva oxide C
Cabreuva oxide C
87.88
C00012438 (-)-Lepidoza-1(10),4(14)-dien-5-ol
Lepidoza-1(10),4(14)-dien-5-ol
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
C00012491 Isokobusone 87.88
C00048855 Sinunorcaryophyllenol 87.88
C00049072 1-Himachalen-4beta-ol
(+)-1-Himachalen-4beta-ol
87.88
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one
87.50
C00016958 gamma-Maaliene 87.50
C00021220 Viridiflorene
Ledene
Ledene Oxide
87.50
C00021230 (+)-Aromadendrene
Aromadendrene
(+)-Aromadendr-7(15)-ene
87.50
C00021833 beta-Panasinsene
beta-Panasinsanene
87.50
C00021885 Norbourbonone 87.50
C00029395 14-Hydroxy-alpha-humulene 87.50
C00029817 (-)-beta-Longipinene
beta-Longipinene
87.50
C00035723 Panaginsene 87.50
C00037332 Isoledene
(-)-Isoledene
87.50
C00048825 Polydactin A 87.50
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