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


and

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




INPUT WORD = C00012826 , 50% or more
[ Metabolite Name : [1R-[1alpha(E),2alpha,4abeta,5beta,8alpha,8aalpha]]- 1,2,3,4,4a,5,8,8a-Octahydro-8-hydroperoxy-5-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenyl ester 3-phenyl-2-propenoic acid ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012824 [1R-[1alpha(E),2alpha,4abeta,5beta,7alpha]]-1,2,3,4,4a,5,6,7-Octahydro-7-hydroperoxy-5-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenyl ester 3-phenyl-2-propenoic acid 95.00
C00012768 Rupestrol cinnamate 91.94
C00012075 Cinnamoylepoxyechinadiol 91.80
C00012705 [1R-[1alpha,4alpha,4aalpha,5alpha(E),6alpha,8abeta]]-Decahydro-4,8a-dimethyl-6-(1-methylethyl)-1,4-epoxynaphthalen-5-yl ester 3-phenyl-2-propenoic acid 91.67
C00012776 [1R-(1alpha,2alpha,4aalpha,5alpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-5-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenyl ester 3-phenyl-2-propenoic acid 91.67
C00020340 Cinnamoylechinaxathol 91.67
C00021962 Vernoeggersic acid 91.67
C00012794 Ivanuol
[1R-(1alpha,2beta,4abeta,5beta,6beta,8aalpha)]-Decahydro-8a-methyl-4-methylene-6-(1-methylethyl)-1,2,5-naphthalenetriol 2-acetate 5-benzoate		 90.00
C00012825 [1R-[1alpha(E),2alpha,4abeta,5beta]]-1,2,3,4,4a,5,6,7-Octahydro-5-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-7-oxo-1-naphthalenyl ester 3-phenyl-2-propenoic acid 90.00
C00020367 Tenuferin 88.52
C00012074 Cinnamoylechinadiol 88.33
C00012851 Decahydro-alpha,4a-dimethyl-8-methylene-7-(1-oxo-3-phenylpropoxy)-2-naphthaleneacetic acid 88.33
C00012925 [3aR-[3aalpha,4aalpha,5(E),8abeta,9aalpha]]- (2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-yl)methyl ester 3-phenyl-2-propenoic acid
Cinnamoyloxyisoalloalantolactone		 88.33
C00043219 6-epi-beta-Verbesinol coumarate 88.33
C00040565 Triptogelin G-2 86.89
C00012452 Juniferinin
Juniperinin		 86.67
C00012706 [1R-(1alpha,4alpha,4aalpha,5alpha,6alpha,8abeta)]-Decahydro-4,8a-dimethyl-6-(1-methylethyl)-1,4-epoxynaphthalen-5-yl ester 4-methoxybenzoic acid 86.67
C00012926 ([3aR-[3aalpha,4aalpha,5(Z),8abeta,9aalpha]]-2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-yl)methyl ester 3-phenyl-2-propenoic acid 86.67
C00016996 Wrightol 86.67
C00020285 2,4-dihydroxycinnamate 86.67
C00021232 Guayulin C 86.67
C00021895 4alpha-Hydroxygymnomitryl cinnamate 86.67
C00031916 Ixerochinolide
(-)-Ixerochinolide		 85.25
C00020241 2alpha-Cinnamoyloxy-9-oxoisoanhydrooplopanone 85.00
C00020284 3,4-dihydroxycinnamate
(-)-Albicanyl		 85.00
C00020366 Tenuferidin 85.00
C00034906 Tokinolide B 85.00
C00040115 Pulchellamine D
(+)-Pulchellamine D		 84.62
C00037070 Drimanial 84.38
C00043936 Suberiphenol
(-)-Suberiphenol		 84.13
C00045094 Strongylophorin 4 83.87
C00012476 6,10,10-Trimethylspiro[bicyclo[7.2.0]undec-5-ene-2,2'-oxirane]-4,8-diol 4-acetate 8-benzoate 83.61
C00021349 8-Coumaroyloxy-14-thapsanol 83.61
C00034345 Youngiajaponicol A
(+)-Youngiajaponicol A		 83.61
C00045041 Reissantin D 83.58
C00007363 delta-Tocopherol 83.33
C00012072 Rubaferinin 83.33
C00012795 [1R-(1alpha,2beta,4abeta,5beta,6beta,8aalpha)]-Decahydro-8a-methyl-4-methylene-6-(1-methylethyl)-1,2,5-naphthalenetriol 1,2-diacetate 5-benzoate 83.33
C00013199 Mortonin
Mortonin A
(5alpha,5aalpha,6alpha,9beta,9aalpha)-6-(Benzoyloxy)-5,5a,6,7,8,9-hexahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-5,9a-(epoxymethano)-1-benzoxepin-10-one		 83.33
C00014611 (-)-Linderatin
(1S-trans)-3-Phenyl-1-[2,4,6-trihydroxy-3-[3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]phenyl]-propanone		 83.33
C00016213 YL 03709B-A
YM 47522		 83.33
C00020865 [3aS-(3aalpha,4alpha,5alpha,9beta,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid 83.33
C00021233 Guayulin D 83.33
C00021399 Ferugin 83.33
C00022649 Gutierrezianolic acid propionate methyl ester 83.33
C00024782 AK-toxin II 83.33
C00031948 Juruenolide E
(+)-Juruenolide E		 83.33
C00037225 Guayulin A 83.33
C00045091 Strongylophorin 22
(-)-Strongylophorin 22		 83.33
C00045678 Basiliskamide A
(-)-Basiliskamide A		 83.33
C00045679 Basiliskamide B
(-)-Basiliskamide B		 83.33
Page Top