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


and

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




INPUT WORD = C00012089 , 50% or more
[ Metabolite Name : [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 ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
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 96.30
C00012094 Budlein A isobutyrate
Viguiepinin		 96.30
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 96.30
C00023259 9beta-Hydroxyatripliciolide-8-O-methacrylate 96.30
C00012090 Lobatin B 94.64
C00023260 9beta-Hydroxyatripliciolide-8-O-angelate 94.64
C00003342 Orizabin 94.44
C00003398 Zexbrevin B 94.44
C00011882 1,2-Dehydrozexbrevin 94.44
C00012115 Ciliarin 94.44
C00012118 NSC 375092 94.44
C00012140 Tagitinin B 94.44
C00036422 17,18-Dehydroviguiepinin
(-)-17,18-Dehydroviguiepinin		 94.44
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 92.73
C00012418 Trichogoniolide 92.73
C00003257 Eremantholide A 92.59
C00003370 Tagitinin F 92.59
C00011866 Tagitinin E 92.59
C00012113 Zexbrevin 92.59
C00012154 Tagitinin A 92.59
C00012300 Resinosolide 92.59
C00012404 Eremantholide C 92.59
C00003226 Budlein A 91.07
C00012088 Isocentratherin 91.07
C00012155 Viguilenin 91.07
C00029417 1beta-Methoxydiversifolin 91.07
C00003293 Goyazensolide 90.91
C00011748 Tomenphantopin B 90.91
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 90.91
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		 90.91
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 90.91
C00012403 Eremantholide B 90.91
C00003246 Deoxyelephantopin 90.74
C00011865 Erioflorin 90.74
C00011989 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 90.74
C00012116 (-)-Lychnopholide
Lychnopholide		 90.74
C00012119 15-Deoxybudlein A
Atripliciolide angelate		 90.74
C00012299 Arcotiopicrin
Orientin (sesquiterpene)		 90.74
C00033537 1beta,2alpha-Epoxytagitinin C 90.74
C00034299 Tagitinin C methylbutyrate 90.74
C00049579 Desacetyl-neurolenin G
(-)-Desacetyl-neurolenin G		 90.74
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
C00023262 9beta-Hydroxy-11beta,13-epoxyatripliciolide-8-O-methacrylate 89.47
C00003338 Niveusin C 89.29
C00012145 Tithonin 89.29
C00003390 Vernomygdin 89.09
C00011996 Zempoalin C 89.09
C00012060 Verafinin C 89.09
C00012270 Jurineolide 89.09
C00013213 [3aS-(3aalpha,4alpha,4abeta,6alpha,9alpha,9aalpha,10beta,10aalpha)]-Dodecahydro-10-hydroxy-9a-methyl-3,5-bis(methylene)-2-oxo-6,9-epoxyfuro[2,3-h][3]benzoxepin-4-yl ester 2-methyl-2-propenoic acid 89.09
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