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


and

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




INPUT WORD = C00010391 , 50% or more
[ Metabolite Name : 8-Bromo-1,3,4,7-tetrachloro-3,7-dimethyl-1,5-octadiene ]
Number of matched data : 73

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010411 1,8-Dibromo-3,4,7-trichloro-3,7-dimethyl-1,5-octadiene 96.55
C00010390 8-Bromo-1,3,4,7-tetrachloro-7-chloromethyl-3-methyl-1,5-octadiene 93.55
C00010418 1,4,8-Tribromo-3,7-dichloro-3,7-dimethyl-1,5-octadiene 93.10
C00038113 1,4,8-Tribromo-3,7-dichloro-3,7-dimethyl-1E,5E-octadiene 93.10
C00010421 1,8,8-Tribromo-3,4,7-trichloro-3,7-dimethyl-1,5-octadiene 90.32
C00010424 1,5,7-Tribromo-2,6,8-trichloro-2,6-dimethyl-3-octene 90.32
C00007453 beta-Elemene
Cyclohexane		 90.00
C00010448 4-Bromo-5-bromomethyl-2,5-dichloro-1-chloroethenyl-1-methylcyclohexane 90.00
C00010457 Violacene 90.00
C00035434 (-)-cis-beta-Elemene 90.00
C00036271 (-)-beta-Elemene 90.00
C00010383 2-(Bromochloromethyl)-1,5,6-trichloro-6-methyl-1,3,7-octatriene 89.66
C00010408 4,8-Dibromo-3,7-dichloro-3,7-dimethyl-1,5-octadiene 89.66
C00010412 1,7-Dibromo-2,6,8-trichloro-3,7-dimethyl-3-octene 89.66
C00010460 4-Bromo-1,5-dichloro-2-chloroethenyl-1,5-dimethylcyclohexane 89.66
C00035372 Plocoralide C 89.66
C00003186 beta-Eudesmene
beta-Selinene		 87.10
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 87.10
C00012715 (-)-beta-Selinene
(-)-Eudesma-4(14),11-diene
[4aS-(4aalpha,7alpha,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 87.10
C00012716 5beta,10alpha-Eudesma-4(14),11-diene
[4aS-(4aalpha,7beta,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 87.10
C00012717 [4aR-(4aalpha,7alpha,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene 87.10
C00012718 beta-Helmiscapene
[4aR-(4aalpha,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 87.10
C00010405 4,6-Dibromo-3,7-dichloro-3,7-dimethyl-1,2-epoxyoctane 86.67
C00012012 gamma-Elemene
(-)-gamma-Elemene		 86.67
C00012454 gamma-Humulene
Isohumulene		 86.67
C00012455 beta-Humulene 86.67
C00049826 Pantopyranoid B
(-)-Pantopyranoid B		 86.67
C00049827 Pantopyranoid C
(-)-Pantopyranoid C		 86.67
C00050105 Germacrene E 86.67
C00010376 Aplysiapyranoid C 86.21
C00010377 Aplysiapyranoid D 86.21
C00010379 7-Bromo-3-bromomethyl-3,6-dichloro-7-methyl-1-octene 86.21
C00010380 6-Bromo-3-bromomethyl-2,3,7-trichloro-7-methyl-1-octene 86.21
C00010417 1,4,6-Tribromo-7-chloro-3,7-dimethyl-1-octen-3-ol 86.21
C00010451 2,4-Dibromo-1-chloro-5-(2-chloroethyenyl)-1,5-dimethylcyclohexane 86.21
C00010452 Gelidene 86.21
C00010453 Mertensene 86.21
C00010461 1,4-Dibromo-5-chloro-2-(2-chloroethenyl)-1,5-dimethylcyclohexane 86.21
C00010463 Plocamene C 86.21
C00011411 2,6,10-Trimethyldodecane
Farnesane		 86.21
C00041581 Halomon
(-)-Halomon		 86.21
C00049423 Apakaochtodene A 86.21
C00049424 Apakaochtodene B 86.21
C00003162 Longifolene aldehyde
Longifolene		 84.85
C00021329 Longicyclene 84.85
C00011559 beta-Monocyclonerolidol 84.38
C00012003 Shyobunon
Shyobunone		 84.38
C00012004 Epishyobunone 84.38
C00012007 Isoshyobunone
iso-Shyobunone
(1S,4S)-2-Isopropylidene-1-vinyl-p-menthan-3-one		 84.38
C00012013 [1S-(1alpha,2beta,3alpha,5alpha)]-2-Ethenyl-2-methyl-3,5-bis(1-methylethenyl)-cyclohexanol 84.38
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al		 84.38
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 84.38
C00016958 gamma-Maaliene 84.38
C00021226 4-Aromadendrene 84.38
C00021227 alpha-Gurjunene 84.38
C00021230 (+)-Aromadendrene
Aromadendrene
(+)-Aromadendr-7(15)-ene		 84.38
C00021283 Cyperene 84.38
C00021286 alpha-Patchoulene 84.38
C00021304 9(15)-Africanene 84.38
C00021720 beta-Cedrene
(+)-beta-Cedrene		 84.38
C00021721 (+)-2,5-Diepi-beta-cedrene 84.38
C00021758 Tricyclovetivene
Zizaene
Khusimene		 84.38
C00021795 Hirsutene 84.38
C00021825 6-Silphiperfolene 84.38
C00021860 (-)-Sativene 84.38
C00021871 Ishwarane 84.38
C00029817 beta-Longipinene
(-)-beta-Longipinene		 84.38
C00035436 (+)-beta-Isolongibornene 84.38
C00035723 Panaginsene 84.38
C00036797 beta-Duprezianene
(+)-beta-Duprezianene		 84.38
C00037346 Isosativene 84.38
C00038071 (+)-alpha-Gurjunene 84.38
C00044034 (+)-beta-Microbiotene 84.38
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