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


and

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




INPUT WORD = C00012118 , 50% or more
[ Metabolite Name : NSC 375092 ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012116 (-)-Lychnopholide
Lychnopholide		 96.30
C00012119 15-Deoxybudlein A
Atripliciolide angelate		 96.30
C00023260 9beta-Hydroxyatripliciolide-8-O-angelate 94.64
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
C00012403 Eremantholide B 94.55
C00000168 1beta,10alpha-Epoxy-8beta,14-dihydroxy-4E,11(13)-germacradien-12,6-olide 94.44
C00000235 Heliangine 94.44
C00011846 Trichomoriolide 94.44
C00011867 (Z,Z)-Heliangin
Leptocarpin		 94.44
C00011882 1,2-Dehydrozexbrevin 94.44
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 94.44
C00012094 Budlein A isobutyrate
Viguiepinin		 94.44
C00012115 Ciliarin 94.44
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 94.44
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		 94.44
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		 94.44
C00034299 Tagitinin C methylbutyrate 94.44
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin		 94.44
C00003226 Budlein A 92.86
C00012088 Isocentratherin 92.86
C00012090 Lobatin B 92.86
C00012145 Tithonin 92.86
C00012155 Viguilenin 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		 92.73
C00003257 Eremantholide A 92.59
C00003342 Orizabin 92.59
C00003370 Tagitinin F 92.59
C00003398 Zexbrevin B 92.59
C00011785 Ursiniolide C 92.59
C00011866 Tagitinin E 92.59
C00012113 Zexbrevin 92.59
C00012140 Tagitinin B 92.59
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 92.59
C00012404 Eremantholide C 92.59
C00012986 Trichomatolide D
(3aR,4R,5aR,6R,9aS,9bR)-[partial]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 92.59
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		 92.59
C00036422 17,18-Dehydroviguiepinin
(-)-17,18-Dehydroviguiepinin		 92.59
C00042502 Eupaheliangolide A
(-)-Eupaheliangolide A		 92.59
C00042506 Eupakirunsin D
(-)-Eupakirunsin D		 92.59
C00003338 Niveusin C 91.07
C00029417 1beta-Methoxydiversifolin 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 90.91
C00012270 Jurineolide 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
C00003246 Deoxyelephantopin 90.74
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 90.74
C00011816 8beta-(2-Methylbutanoyl)-14-hydroxy-1(10),4E,11(13)-germacratrien-12,6beta-olide 90.74
C00011847 Eupachifolin A 90.74
C00011859 (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 2-methylbutanoic acid 90.74
C00011865 Erioflorin 90.74
C00011984 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 90.74
C00011992 Zinaflorin V 90.74
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 90.74
C00012114 Ladibranolide 90.74
C00012154 Tagitinin A 90.74
C00012260 Deoxytifruticin 90.74
C00012276 Linearilobin F 90.74
C00012299 Arcotiopicrin
Orientin (sesquiterpene)		 90.74
C00012300 Resinosolide 90.74
C00012399 Zinangustolide 90.74
C00012419 Pycnolide 90.74
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		 90.74
C00013234 (-)-Tirotundifolin B
Tirotundifolin B
(3aR,4R,5aR,6R,9bS)-[partial]-2,3,3a,4,5,5a,6,7,8,9b-Decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 90.74
C00020505 Epicentaurepensin
Linichlorin B		 90.74
C00023259 9beta-Hydroxyatripliciolide-8-O-methacrylate 90.74
C00039365 Helivypolide D 90.74
C00042504 Eupakirunsin B
(-)-Eupakirunsin B		 90.74
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