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


and

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




INPUT WORD = C00012090 , 50% or more
[ Metabolite Name : Lobatin B ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
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 94.64
C00023260 9beta-Hydroxyatripliciolide-8-O-angelate 94.64
C00012118 NSC 375092 92.86
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 92.86
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 91.23
C00003226 Budlein A 91.07
C00012086 [3aS-(3aR*,4R*,5R*,6S*,10R*,11aS*)]-2,3,3a,4,5,6,7,10,11,11a-Decahydro-5-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid 91.07
C00012088 Isocentratherin 91.07
C00012094 Budlein A isobutyrate
Viguiepinin		 91.07
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 91.07
C00012145 Tithonin 91.07
C00012155 Viguilenin 91.07
C00012228 6-Formyl-2,3,3a,4,5,8,9,11a-octahydro-5-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 91.07
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		 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
C00012318 Lobatin A 91.07
C00023259 9beta-Hydroxyatripliciolide-8-O-methacrylate 91.07
C00029417 1beta-Methoxydiversifolin 91.07
C00041071 Neurolenin D 91.07
C00011750 Liscundin 89.47
C00000235 Heliangine 89.29
C00003338 Niveusin C 89.29
C00003342 Orizabin 89.29
C00003398 Zexbrevin B 89.29
C00011840 Douglasin 89.29
C00011846 Trichomoriolide 89.29
C00011860 (3aR,4R,6E,10Z,11aR)-6-Formyl-2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 3-methylbutanoic acid 89.29
C00011867 (Z,Z)-Heliangin
Leptocarpin		 89.29
C00011882 1,2-Dehydrozexbrevin 89.29
C00012115 Ciliarin 89.29
C00012116 (-)-Lychnopholide
Lychnopholide		 89.29
C00012119 15-Deoxybudlein A
Atripliciolide angelate		 89.29
C00012136 Tifruticin 89.29
C00012140 Tagitinin B 89.29
C00012147 Niveusin B 89.29
C00012152 Argophyllin B 89.29
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		 89.29
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		 89.29
C00012257 (+)-Montafrusin B
Montafrusin B		 89.29
C00012270 Jurineolide 89.29
C00012403 Eremantholide B 89.29
C00012418 Trichogoniolide 89.29
C00021150 Pulckelloid B 89.29
C00033648 Anthemolide D
(+)-Anthemolide D		 89.29
C00034299 Tagitinin C methylbutyrate 89.29
C00036422 17,18-Dehydroviguiepinin
(-)-17,18-Dehydroviguiepinin		 89.29
C00039366 Helivypolide E 89.29
C00041070 Neurolenin C 89.29
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin		 89.29
C00042505 Eupakirunsin C
(-)-Eupakirunsin C		 89.29
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