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


and

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




INPUT WORD = C00037925 , 50% or more
[ Metabolite Name : trans,trans-Xanthoxin ]
Number of matched data : 120

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00007240 cis,trans-Xanthoxin
2-cis,2-trans-Xanthoxin
(-)-Xanthoxin		 100.00
C00036906 CID is old! 100.00
C00011555 5-(1,4-Dihydroxy-2,2-dimethyl-6-methylenecyclohexyl)-3-methyl-2,4-pentadienoic acid 94.74
C00012771 Pterocarptriol
[1R-(1alpha,3alpha,4abeta,7beta,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,3-naphthalenediol		 91.89
C00012772 Pterocarpdiolone
[4R-(4alpha,4aalpha,6beta,8abeta)]-Octahydro-4-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone		 91.89
C00000134 Abscisic acid
(s)-(+)-Abscisic acid
2,4-Pentadienoic acid
cis-abscisic acid		 89.47
C00011542 Aeginetic acid
Eginetic acid		 89.47
C00021612 4-Chloro-3,7-epoxy-9-chamigranone 89.47
C00003119 Cuauhtemone 89.19
C00003174 Piperdial 89.19
C00007236 Abscisic acid aldehyde 89.19
C00011491 (-)-Ngaione
cis-Ngaione
4-Methyl-1-[(2S,5R)-2,3,4,5-tetrahydro-5-methyl[2,3'-bifuran]-5-yl]-2-pentanone		 89.19
C00011493 (-)-Epingaione 89.19
C00011545 (E)-(+)-2-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-2-butenedial 89.19
C00012386 Chamissellin
Deacetyllaurenobiolide
Desacetyllaurenobiolide		 89.19
C00012773 Pigmol
Pygmol
[1R-(1alpha,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,8-naphthalenediol		 89.19
C00012798 Longilobol
(2alpha,3beta,4aalpha,8abeta)-(+)-Octahydro-3-(1-hydroxy-1-methylethyl)-8a-methyl-5-methylene-2,4a(2H)-naphthalenediol		 89.19
C00020269 Uvidin E 89.19
C00020278 Isoalbrassitriol 89.19
C00021395 Pallinol 89.19
C00021405 Lapidol 89.19
C00021551 Piperalol 89.19
C00021552 8-Epipipertriol 89.19
C00031162 Rhombitriol
(-)-Rhombitriol		 89.19
C00041689 Neobritannilactone B 89.19
C00003170 Phaseic acid 87.80
C00033819 Epidihydrophaseic acid 87.80
C00038084 (+)-Phaseic acid 87.80
C00029305 (+)-Methyl abscisate 87.50
C00011773 Shonachalin A 87.18
C00011437 (-)-Athanagrandione 86.84
C00012604 [3S-[3alpha,4beta,7bbeta(1S*,2R*)]]-7-(2-Hydroxy-1,4-dimethyl-3-cyclohexen-1-yl)-7-methyl-1-oxaspiro[2.4]heptan-4-ol
Isotrichodiol		 86.84
C00012916 Telekin
Telekine
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-Decahydro-4a-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 86.84
C00012918 5-Epitelekin
[3aR-(3aalpha,4abeta,8abeta,9aalpha)]-Decahydro-4a-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 86.84
C00014976 Africantriol 86.84
C00020260 7beta-Hydroxydihydrodrimenin 86.84
C00020261 7-Oxodihydrodrimenin 86.84
C00020421 Kessoglycol
3beta,6alpha-Dihydroxykessane		 86.84
C00020728 Trifloculoside 86.84
C00020799 Involucratolactone
8alpha-Hydroxy-11,13-dihydrodehydrocostuslactone		 86.84
C00021975 Guimarediol 86.84
C00023427 (-)-Sclareolide
ent-Norambreinolide		 86.84
C00033139 Madolin B 86.84
C00045951 Furodysin lactone 86.84
C00046105 Macrophyllic acid D
(-)-Macrophyllic acid D		 86.84
C00046106 Macrophyllic acid E
(+)-Macrophyllic acid E		 86.84
C00048497 Nor-ambreinolide
(+)-Nor-ambreinolide		 86.84
C00003128 Dehydrongaione 86.49
C00003152 Ipomoeamarone
(+)-Ngaione		 86.49
C00003185 Seiricardine A 86.49
C00011434 Caparrapitriol 86.49
C00011463 [2R-[2alpha(2R*,4E),5beta]]-2-(5-Ethenyltetrahydro-5-methyl-2-furanyl)-6-hydroxy-6-methyl-4-hepten-3-one 86.49
C00011484 Myoporon
Myoporone
(S)-1-(3-Furanyl)-4,8-dimethyl-1,6-nonanedione		 86.49
C00011492 Dehydroipomeamarone
(2R-cis)-4-Methyl-1-(2,3,4,5-tetrahydro-5-methyl[2,3'-bifuran]-5-yl)-3-penten-2-one		 86.49
C00011494 (2S-trans)-4-Methyl-1-(2,3,4,5-tetrahydro-5-methyl[2,3'-bifuran]-5-yl)-3-penten-2-one 86.49
C00011516 Caulolactone B 86.49
C00011517 Caulolactone A 86.49
C00011529 Cyclonerodiol oxide 86.49
C00011546 (+-)-Ancistrofuran
Ancistrofuran		 86.49
C00011556 [R-(Z,E)]-5-(2,2-Dimethyl-6-methylenecyclohexyl)-3-methyl-2,4-pentadien-1-ol 86.49
C00011557 gamma-Monocyclofarnesol
trans-gamma-Monocyclofarnesol		 86.49
C00011700 (+)-Epoxypuliglene
Epoxypuliglene		 86.49
C00012069 (+)-Germacrone-4,5-epoxide
(4S,5S)-(+)-Germacrone 4,5-epoxide		 86.49
C00012175 [3S-(3R*,3aR*,10E,11aR*)]-3a,5,6,8,9,11a-Hexahydro-3,10-dimethyl-6-methylene-cyclodeca[b]furan-2,7(3H,4H)-dione 86.49
C00012177 Gallicin 86.49
C00012178 [3R-(3R*,3aS*,10E,11aS*)]-3a,5,6,8,9,11a-Hexahydro-3,10-dimethyl-6-methylene-cyclodeca[b]furan-2,7(3H,4H)-dione 86.49
C00012414 [2alpha(E),3alpha(E)]-3-Methyl-4-[tetrahydro-3-(3-methyl-1,3-butadienyl)-4-methylene-5-oxo-2-furanyl]-2-butenal 86.49
C00012415 [2alpha(Z),3alpha(E)]- 3-Methyl-4-[tetrahydro-3-(3-methyl-1,3-butadienyl)-4-methylene-5-oxo-2-furanyl]-2-butenal 86.49
C00012520 Cuprenolide 86.49
C00012603 12,13-Epoxytrichothec-9-ene 86.49
C00012765 Cryptomeridiol
Proximadiol
Selina-4,7-diol
Selinane-4alpha,11-diol		 86.49
C00012766 (-)-10-epi-5beta,11-Dihydroxyeudesmane
[2R-(2alpha,4abeta,8alpha,8aalpha)]-Decahydro-8a-hydroxy-a,a,4a,8-tetramethyl-2-naphthalenemethanol		 86.49
C00012782 (+)-Pterocarpol
Eudesm-4(14)-ene-2a,11-diol
[2R-(2alpha,4aalpha,6beta,8abeta)]-decahydro-6-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 86.49
C00012799 (+)-Kudtriol
Kudtriol
Kutdtriol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 86.49
C00012800 5-epi-Kudtriol
5-epi-Kutdtriol
[2R-[2alpha(R*),4aalpha,8aalpha]]-2-(Decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 86.49
C00013101 [1aR-(1aalpha,3abeta,6beta,8abeta,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin 86.49
C00013102 [1aS-(1aalpha,3aalpha,6alpha,8aalpha,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin 86.49
C00013104 4-Hydroxydihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-9-ol		 86.49
C00020060 Isokhusinoloxide 86.49
C00020142 Pernetic acid A 86.49
C00020228 [1S-(1alpha,4alpha,4aalpha,8aalpha)]-1,3,4,4a,5,8a-Hexahydro-1-hydroxy-4,7-dimethyl-1-(1-methylethyl)-2,6-naphthalenedione 86.49
C00020236 3,10-Dihydroxy-4-oplopanone
3-Hydroxyoplopanone		 86.49
C00020270 [1S-(1alpha,2alpha,3beta,4abeta,8aalpha)]-Decahydro-1-(hydroxymethyl)-2,5,5,8a-tetramethyl-2,3-naphthalenediol 86.49
C00020276 Polygonic acid 86.49
C00020357 Zedoarondiol 86.49
C00021019 3-Desoxo-achalensolide 86.49
C00021400 Lancerodiol 86.49
C00021409 Feruone 86.49
C00021599 4-Chloro-3,7(14)-chamigradien-9-ol 86.49
C00021627 3-Bromo-4-chloro-7(14)-chamigren-9-ol 86.49
C00021776 Clovane-2beta,9alpha-diol
Cloven-2beta,9alpha-diol
Clovanediol		 86.49
C00021881 Hinokiic acid
Thujopsenic acid
Widdrenic acid		 86.49
C00021964 Widdrol epoxide 86.49
C00022013 1,5,8,8-Tetramethyl-8-bicyclo[8.1.0]undecene-2,9-diol 86.49
C00022190 Apo-11-zeaxanthinal 86.49
C00022681 11-Hydroxy-4,5-seco-eudesmane-4,5-dione 86.49
C00029543 4S-Dihydrocurcumenone 86.49
C00030062 Curcarabranol A 86.49
C00030063 Curcarabranol B
(+)-Curcarabranol B		 86.49
C00030068 Curcumenone 86.49
C00030338 Gajutsulactone A
(-)-Gajutsulactone A		 86.49
C00030339 Gajutsulactone B
(-)-Gajutsulactone B		 86.49
C00030542 Isoprocurcumenol 86.49
C00030554 Isozedoarondiol 86.49
C00030609 Kikkanol A
(+)-Kikkanol A		 86.49
C00033538 1beta,4beta,7alpha-Trihydroxyeudesmane
(-)-1beta,4beta,7alpha-Trihydroxyeudesmane		 86.49
C00033919 Homalomenol E 86.49
C00034362 11-epi-Gallicin 86.49
C00035108 Ganomastenol D 86.49
C00035496 4,5-epi-Cryptomeridiol 86.49
C00039450 Isopolygodial
(-)-Isopolygodial		 86.49
C00042891 Pulioplopanone B
(+)-Pulioplopanone B		 86.49
C00044091 Annuionone C
(-)-Annuionone C		 86.49
C00045712 Cadinanetriol
(+)-Cadinanetriol		 86.49
C00046103 Macrophyllic acid B
(-)-Macrophyllic acid B		 86.49
C00046104 Macrophyllic acid C
(+)-Macrophyllic acid C		 86.49
C00046110 Madolin W 86.49
C00046527 Xenitorin D
(-)-Xenitorin D		 86.49
C00047347 Sch 601253 86.49
C00047349 Sch 725432 86.49
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