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


and

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




INPUT WORD = C00012459 , 50% or more
[ Metabolite Name : (Z,E,E)-5,8,8-Trimethyl-1,5,9-cycloundecatriene-1-carboxaldehyde , alpha-Humulen-14-al ]
Number of matched data : 64

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012463 (+)-Humulenol II
Humulenol
Humulenol II		 96.88
C00036063 Buddledone A 96.88
C00012472 14-Hydroxy-9-epi-(beta)-caryophyllene
14-Hydroxy-9-epi-beta-caryophyllene		 93.94
C00012503 (+)-Bicyclohumulenone
Bicyclohumulenone
[1S-(1R*,5E,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undec-5-en-2-one		 93.94
C00021899 Allohimachalol 93.94
C00021901 4-Ambiguen-1-ol 93.94
C00046584 4,5-Dihydro-beta-caryophyllene-14-al
(-)-4,5-Dihydro-beta-caryophyllene-14-al		 93.94
C00012455 beta-Humulene 93.75
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 93.75
C00012467 Zerumbone 93.75
C00021226 4-Aromadendrene 93.75
C00021227 alpha-Gurjunene 93.75
C00021982 Italicene 93.75
C00029395 14-Hydroxy-alpha-humulene 93.75
C00038071 (+)-alpha-Gurjunene 93.75
C00012460 (1R*,3E,7E,11S*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-methanol
1alpha,10beta-Epoxy-alpha-humulen-14-ol		 91.43
C00012461 (1R*,3E,7E,11R*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-carboxaldehyde
6alpha,7beta-Epoxy-2,9-humuladien-14-al		 91.43
C00022019 Vulgarone A 91.18
C00031538 2,9-Humuladien-6-ol-8-one
(-)-2,9-Humuladien-6-ol-8-one		 91.18
C00038073 (+)-Aromadendr-4-en-12-ol 91.18
C00003109 Carotol 90.91
C00003145 Himachalol 90.91
C00012424 [1R-(1R*,2E,6E,10S*,11S*)]-3,7,11-Trimethylbicyclo[8.1.0]undeca-2,6-diene-11-carboxaldehyde
13-Bicyclogermacrenal		 90.91
C00012444 Humulene 1,2-epoxide
Humulene epoxide II
(-)-Humulene epoxide II
Humulene 6,7-epoxide
Humulene II epoxide
Humulene oxide II		 90.91
C00012743 (+)-gamma-Costal
gamma-Costal
Iso-beta-costal
(2R-cis)- 1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetaldehyde		 90.91
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		 90.91
C00012750 (+)-Costal
Costic aldehyde
(+)-beta-Costal
Eudesma-4(14),11(13)-dien-12-al		 90.91
C00020129 (+)-Sclerosporal 90.91
C00021311 alpha-Torosol 90.91
C00029912 Caryophylladienol I 90.91
C00029913 Caryophylla-4(12),8(13)-dien-5beta-ol
Caryophylladienol II
Caryophylla-4(12),8(13)-dien-5alpha-ol		 90.91
C00036062 Buddledin E 90.91
C00048351 Caryophylla-4(14),8(15)-dien-5alpha-ol 90.91
C00003147 alpha-Caryophyllene (obsol.)
alpha-Caryophyllene
alpha-Humulene
Humulene
(+/-)-alpha-Humulene		 90.63
C00011637 Helianthol A
[R-(E)]-2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-4,6-heptadien-2-ol		 90.63
C00011723 Agerol 90.63
C00011724 4(15),5E,10(14)-Germacratrien-1alpha-ol 90.63
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al		 90.63
C00012425 (+)-Bicyclogermacrene
Bicyclogermacren
Bicyclogermacrene
Biclyclogermacrene		 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
C00016958 gamma-Maaliene 90.63
C00020384 6,9-Guaiadiene 90.63
C00021230 (+)-Aromadendrene
Aromadendrene
(+)-Aromadendr-7(15)-ene		 90.63
C00021308 beta-Himachalene 90.63
C00021309 alpha-Himachalene 90.63
C00021310 gamma-Himachalene 90.63
C00021476 1-Sterpurene 90.63
C00021758 Tricyclovetivene
Zizaene
Khusimene		 90.63
C00021772 (+)-Prezizaene 90.63
C00021773 (-)-Prezizaene 90.63
C00021833 beta-Panasinsene
beta-Panasinsanene		 90.63
C00022495 10-Oxo-10,11H-beta-bisabolene 90.63
C00029817 (-)-beta-Longipinene
beta-Longipinene		 90.63
C00029818 beta-Maaliene 90.63
C00035627 Ginsinsene 90.63
C00035723 Panaginsene 90.63
C00035811 beta-Funebrene
(-)-beta-Funebrene		 90.63
C00036272 (-)-Bicyclogermacrene
ent-Bicyclogermacrene		 90.63
C00036299 (+)-Amorpha-4,11-diene 90.63
C00036614 6-epi-alpha-Cubebene
(+)-6-epi-alpha-Cubebene		 90.63
C00036712 alpha-Cuprenene 90.63
C00037322 Isobicyclogermacrene
(+)-Isobicyclogermacrene		 90.63
C00037332 Isoledene
(-)-Isoledene		 90.63
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