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


and

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




INPUT WORD = C00034299 , 50% or more
[ Metabolite Name : Tagitinin C methylbutyrate ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00042502 Eupaheliangolide A
(-)-Eupaheliangolide A		 98.11
C00011882 1,2-Dehydrozexbrevin 96.23
C00012260 Deoxytifruticin 96.23
C00042504 Eupakirunsin B
(-)-Eupakirunsin B		 96.23
C00012304 [3aR-[3aR*,4R*(Z),6S*,9S*,10Z,11aR*]]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-6,9-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid 94.55
C00000235 Heliangine 94.44
C00011867 (Z,Z)-Heliangin
Leptocarpin		 94.44
C00012118 NSC 375092 94.44
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin		 94.44
C00003370 Tagitinin F 94.34
C00011846 Trichomoriolide 94.34
C00011856 Tagitinin C 94.34
C00011866 Tagitinin E 94.34
C00012301 [3aR-[3aR*,4R*(Z),6S*,9R*,10E,11aR*]]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-6,9-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid
3alpha-Hydroxytrichomoriolide		 92.73
C00000168 1beta,10alpha-Epoxy-8beta,14-dihydroxy-4E,11(13)-germacradien-12,6-olide 92.59
C00012140 Tagitinin B 92.59
C00042506 Eupakirunsin D
(-)-Eupakirunsin D		 92.59
C00003249 Deacetyleupaserrin
Desacetyleupaserrin		 92.45
C00011865 Erioflorin 92.45
C00012244 Jamaicolide C
(2Z)-(3aR,4R,7R,9S,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-Decahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid		 92.45
C00012245 Calbertolide C
(2E)-(3aR,4R,7R,9S,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-Decahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid		 92.45
C00012145 Tithonin 91.07
C00012155 Viguilenin 91.07
C00023260 9beta-Hydroxyatripliciolide-8-O-angelate 91.07
C00011785 Ursiniolide C 90.74
C00012089 [3aS-(3aR*,4R*,5S*,6S*,10Z,11aS*)]- 2,3,3a,4,5,6,7,11a-Octahydro-5-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid 90.74
C00012094 Budlein A isobutyrate
Viguiepinin		 90.74
C00012116 (-)-Lychnopholide
Lychnopholide		 90.74
C00012119 15-Deoxybudlein A
Atripliciolide angelate		 90.74
C00012143 2,3,3a,4,5,6,7,8,9,11a-Decahydro-9-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid 90.74
C00012956 Tanapsin
[3aR-[3aalpha,4alpha(Z),4aalpha,5beta,8beta,8abeta,9abeta]]-Dodecahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.74
C00013087 Trichomatolide C
[3aR-[3aalpha,4beta(E),5abeta,6beta,8alpha,9bbeta]]- 2,3,3a,4,5,5a,6,7,8,9b-Decahydro-6,8-dihydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.74
C00039365 Helivypolide D 90.74
C00003246 Deoxyelephantopin 90.57
C00003262 Eriolangin 90.57
C00003278 Eupatoriopicrin 90.57
C00011808 2,3,3a,4,5,8,9,11a-Octahydro-5,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-butanoic acid 90.57
C00011887 Tagitinin D
Tirotundin		 90.57
C00012115 Ciliarin 90.57
C00012256 Montafrusin
Montafrusin A		 90.57
C00012257 (+)-Montafrusin B
Montafrusin B		 90.57
C00012259 Zoapatanolide B 90.57
C00012267 2,3,3a,4,5,8,9,11a-Octahydro-6,10-bis(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 90.57
C00012276 Linearilobin F 90.57
C00012300 Resinosolide 90.57
C00012419 Pycnolide 90.57
C00012867 beta-Cyclotanacin
Chrysanin
Taxillin
[3aR-[3aalpha,4alpha(Z),4aalpha,8beta,8abeta,9abeta]]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.57
C00032954 Eupaglehnin C
(+)-Eupaglehnin C		 90.57
C00033835 Estafiatin 8-O-angelate 90.57
C00033836 Estafiatin 8-O-isovalerate 90.57
C00034401 8alpha-Angeloxyartabsin 90.57
C00034403 8alpha-Tigloxyartabsin 90.57
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