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


and

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




INPUT WORD = C00012313 , 50% or more
[ Metabolite Name : Caleurticolide angelate ]
Number of matched data : 70

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012310 Juanislamin 96.92
C00035815 Calealactone A 95.38
C00012371 Incaspitolide E 90.91
C00035787 2,3-Epoxyjuanislamin 90.91
C00012290 Melcanthin F 90.77
C00012307 Calein B 90.77
C00012312 Caleurticolide acetate 90.77
C00012397 Incaspitolide D 90.77
C00012401 Incaspitolide A 90.77
C00049591 Neurolenin H 90.77
C00050339 Cardivin D
(-)-Cardivin D		 90.77
C00012165 [3aS-[3aR*,4R*,5S*(Z),6S*,10Z,11aS*]]-2,3,3a,4,5,6,7,11a-Octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-4-[(2-methyl-1-oxo-2-propenyl)oxy]-2,7-dioxo-6,9-epoxycyclodeca[b]furan-5-yl ester 2-methyl-2-butenoic acid 89.71
C00050337 Cardivin B
(-)-Cardivin B		 89.55
C00050338 Cardivin C 89.55
C00012130 [1aR-(1aR*,5R*,7S*,10aS*,10bR*)]-5-(Acetyloxy)-8-[(acetyloxy)methyl]-2,3,6,7,10a,10b-hexahydro-1a,5-dimethyl-7-(1-oxopropoxy)-oxireno[9,10]cyclodeca[1,2-b]furan-4,9(1aH,5H)-dione 89.39
C00033935 Hydruntinolide B
(-)-Hydruntinolide B		 89.39
C00012087 [3aS-(3aR*,4R*,5R*,6S*,10R*,11aS*)]- 5-(Acetyloxy)-2,3,3a,4,5,6,7,10,11,11a-decahydro-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid 89.23
C00012306 Calein A 89.23
C00012308 Calein C 89.23
C00012309 Calein D 89.23
C00012311 Neurolenin B 89.23
C00012317 Disyfolide 89.23
C00033601 8-O-Angeloyl-9-acetylanthemolide B 89.23
C00049590 Neurolenin G 89.23
C00012166 [3aS-(3aR*,4R*,5S*,6S*,10Z,11aS*)]-2,3,3a,4,5,6,7,11a-Octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-4-[(2-methyl-1-oxo-2-propenyl)oxy]-2,7-dioxo-6,9-epoxycyclodeca[b]furan-5-yl ester 3-methyl-2-butenoic acid 88.24
C00042557 Glaucolide K
(-)-Glaucolide K		 87.88
C00003261 Erioflorin methacrylate 87.69
C00011853 Acanthospermal A 87.69
C00012135 Vicolide C 87.69
C00012287 Melcanthin A 87.69
C00012297 [3aS-(3aR*,4R*,5R*,6E,10R*,11aS*)]- 5-(Acetyloxy)-2,3,3a,4,5,8,9,10,11,11a-decahydro-10-(hydroxymethyl)-3-methylene-4-(2-methyl-1-oxopropoxy)-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester
9alpha-Acetoxymelnerin A		 87.69
C00012298 [3aS-[3aR*,4R*(S*),5R*,6E,10R*,11aS*]]-5-(Acetyloxy)-2,3,3a,4,5,8,9,10,11,11a-decahydro-10-(hydroxymethyl)-3-methylene-4-(2-methyl-1-oxobutoxy)-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester
9alpha-Acetoxymelnerin B		 87.69
C00020879 8-Acetylpumilin
8-O-Acetyl pumilin		 87.69
C00030485 Hispidunolide A 87.69
C00033603 8-O-Isobutyryl-9-O-acetylanthemolide B
(-)-8-O-Isobutyryl-9-O-acetylanthemolide B		 87.69
C00050336 Cardivin A
(-)-Cardivin A		 86.96
C00033934 Hydruntinolide C
(-)-Hydruntinolide C		 86.76
C00012292 Longicornin B 86.57
C00003294 Gradolide 86.36
C00012125 Piptocarphin E 86.36
C00021414 Lapidolin 86.36
C00003264 Eupachlorin acetate 86.15
C00011854 Acanthoglabrolide 86.15
C00011855 Acanthospermal B 86.15
C00011879 Fluctuadin 86.15
C00012207 Melampolidin 86.15
C00012227 5-(Acetyloxy)-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 86.15
C00012241 [3aS-[3aR*,4R*(Z),5R*,6R*,9S*,10E,11aS*]]-5-(Acetyloxy)-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-methylbutenoic acid 86.15
C00012281 Repandin E 86.15
C00012289 Melcanthin E 86.15
C00012291 Melcanthin G 86.15
C00012302 [3aR-[3aR*,4R*(Z),6S*,9R*,10E,11aR*]]-9-(Acetyloxy)-2,3,3a,4,5,6,7,8,9,11a-decahydro-6-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid
3alpha-Acetoxytrichomoriolide		 86.15
C00012303 Piptolepolide 86.15
C00020556 Talassin B 86.15
C00020844 Linichlorin C 86.15
C00020846 Skutchiolide A 86.15
C00020867 [3aS-[3aalpha,4alpha,5beta(Z),9alpha,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid 86.15
C00021149 9-O-Desacetylspathulin 2-O-angelate
Gaigrandin		 86.15
C00021326 Triflorestevione 86.15
C00021327 Rastevione 86.15
C00023261 9beta-Acetoxyatripliciolide-8-O-methacrylate 86.15
C00023263 9beta-Acetoxy-11beta,13-epoxyatripliciolide-8-O-methacrylate 86.15
C00032482 Vernolide B 86.15
C00033604 8-O-Tigloyl-9alpha-acetoxycumambrin B 86.15
C00035816 Calealactone B 86.15
C00038978 Dendronpholide L
(-)-Dendronpholide L		 86.15
C00040770 15-Acetoxyeremantholide B 86.15
C00042052 15-Acetoxyheliangin 86.15
C00042559 Glaucolide M
(+)-Glaucolide M		 86.15
C00049580 Lobatin D
(-)-Lobatin D		 86.15
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