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


and

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




INPUT WORD = C00023189 , 50% or more
[ Metabolite Name : 3-Deacetyleupalinin A ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003338 Niveusin C 94.64
C00012136 Tifruticin 94.64
C00011858 Peroxysachalinin 92.98
C00000235 Heliangine 92.86
C00003226 Budlein A 92.86
C00011867 (Z,Z)-Heliangin
Leptocarpin		 92.86
C00012153 (-)-Argophyllone B
Argophyllone B		 92.86
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		 92.86
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		 92.86
C00029417 1beta-Methoxydiversifolin 92.86
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin		 92.86
C00042506 Eupakirunsin D
(-)-Eupakirunsin D		 92.86
C00003391 Viguiestenin 91.38
C00011869 Viguiestin 91.38
C00011744 Cordifene
Erlancorin		 91.23
C00011750 Liscundin 91.23
C00012413 8beta-Tigloyloxy-2,3-seco-4Z,11(13)-heliangadiene-3,10beta:6,12-diolid-2-oic acid 91.23
C00011868 Argophyllin C 91.07
C00012058 (+)-20-Hydroxyelemajurinelloide 91.07
C00012110 Punctaliatrin
Punctatin
Punctatin		 91.07
C00012116 (-)-Lychnopholide
Lychnopholide		 91.07
C00012145 Tithonin 91.07
C00012147 Niveusin B 91.07
C00012151 Argophyllin A 91.07
C00012152 Argophyllin B 91.07
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		 91.07
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		 91.07
C00012260 Deoxytifruticin 91.07
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 91.07
C00012316 [3aS-[3aR*,4R*(Z),5R*,6R*,10E,11aS*]]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-5,6-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid 91.07
C00012403 Eremantholide B 91.07
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		 91.07
C00012987 Trichomatolide E
[3aR-[3aalpha,4beta(E),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-(hydroxymethyl)-2-butenoic acid		 91.07
C00013086 Trichomatolide B
[3aR-[3aalpha,4beta(E),5abeta,6beta,8alpha,9aalpha,9bbeta]]-Dodecahydro-6,8-dihydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 91.07
C00020489 Eupahakonin A 91.07
C00020877 [3aR-(3aalpha,4beta,6beta,6aalpha,9aalpha,9bbeta)]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-6,8-dihydroxy-6,9-dimethyl-3-methylene-2,7-dioxoazuleno[4,5-b]furan-4-yl ester 2-methyl-2-butenoic acid 91.07
C00039365 Helivypolide D 91.07
C00042504 Eupakirunsin B
(-)-Eupakirunsin B		 91.07
C00042507 Eupakirunsin E
(-)-Eupakirunsin E		 91.07
C00003266 Eupacunin 89.83
C00003260 Acetylerioflorin
Erioflorin acetate		 89.66
C00011873 Sphaerocephalin 89.66
C00012134 Niveusin A 89.66
C00020460 Eupachifolin E 89.66
C00011749 Cordifolia P2 89.47
C00012092 Lychnophorolide A
Centratherin		 89.47
C00012240 [3aS-[3aR*,4R*(Z),5R*,6R*,9S*,10E,11aS*]]-2-Methyl-, 2,3,3a,4,5,6,7,8,9,11a-decahydro-5,6,9-trihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-butenoic acid 89.47
C00020629 Bahia II 89.47
C00020702 [3aR-[3aalpha,4beta(S*),6alpha,6aalpha,7beta,7abeta,8abeta,8balpha,8cbeta]]-Dodecahydro-6,7-dihydroxy-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid 89.47
C00040771 15-Hydroxyeremantholide B 89.47
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