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


and

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




INPUT WORD = C00020798 , 50% or more
[ Metabolite Name : Subexpinnatin ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00049965 8beta-Isobutyryloxycumambranolide
(-)-8beta-Isobutyryloxycumambranolide		 98.00
C00020503 Acroptin 96.15
C00020794 [3aR-[3aalpha,4beta(E),6aalpha,9aalpha,9bbeta]]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-9-methyl-3,6-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 4-hydroxy-2-methyl-2-butenoic acid 94.23
C00020801 [3aS-[3aalpha,5alpha(Z),6aalpha,9aalpha,9bbeta]]-Dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid 94.00
C00003243 Cynaropicrin 92.31
C00003366 Saupirin
sauparine		 92.31
C00020513 Dehydrocyanaropicrin 92.31
C00020525 9beta-Hydroxy-8beta-tiglinoyloxy-lasiolaenin 92.31
C00003215 Arctiopicrin 92.16
C00003341 Onopordopicrin 92.16
C00020511 Aguerin A 92.00
C00020512 Aguerin B 92.00
C00045462 Zaluzanin C isobutyrate
(+)-Zaluzanin C isobutyrate		 92.00
C00020482 Breviarolide 90.74
C00020788 Eupahakonenin A 90.74
C00020479 Angeloylcumambrin B 90.38
C00020735 Repdiolide 90.38
C00020790 Bahia III 90.38
C00021164 Isochiapin B 90.38
C00030468 Hemistepsin 90.38
C00038458 Annuolide F 90.38
C00038739 Chiapin B 90.38
C00003208 Alatolide 90.20
C00011856 Tagitinin C 90.20
C00020623 [3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-2,3,3a,4,5,7,7a,8a,8b,8c-Decahydro-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-7-yl ester 2-methyl-2-propenoic acid 90.20
C00029909 Carlaolide A
(-)-Carlaolide A		 90.20
C00012868 Subcordatolide C
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9aalpha)]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid		 90.00
C00020521 Diaspanolide A 90.00
C00020800 Vernudifloride 90.00
C00020802 [3aS-(3aalpha,5alpha,6aalpha,9aalpha,9bbeta)]-Dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-5-yl ester 3-methyl-2-butenoic acid 90.00
C00020824 8alpha-Isovaleryloxyeremanthine 90.00
C00033595 8alpha-Isobutyryloxydouglanin 90.00
C00034862 Isobutyryl helenalin 90.00
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		 88.89
C00020481 Hydrobahia III 88.89
C00020850 Acrorepiolide 88.89
C00011779 [3aR-[3aR*,4R*(S*),6E,8S*,10E,11aR*]]-2,3,3a,4,5,8,9,11a-Octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 3-hydroxy-2-methylene-butanoic acid 88.68
C00020594 19-Deoxyjanerin
Desoxyrepin		 88.68
C00033835 Estafiatin 8-O-angelate 88.68
C00033836 Estafiatin 8-O-isovalerate 88.68
C00038329 8alpha-Epoxymethylacrylyloxyambrosin 88.68
C00011887 Tagitinin D
Tirotundin		 88.46
C00012867 beta-Cyclotanacin
Chrysanin
Taxillin
[3aR-[3aalpha,4alpha(Z),4aalpha,8beta,8abeta,9abeta]]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 88.46
C00020506 8alpha-Acetoxyzaluzanin D 88.46
C00020858 Subcordatolide A 88.46
C00034017 Lactucin-15-oxalate 88.46
C00003229 Chamissonin diacetate 88.24
C00003333 Molephantin 88.24
C00011780 Mollisorin A 88.24
C00011816 8beta-(2-Methylbutanoyl)-14-hydroxy-1(10),4E,11(13)-germacratrien-12,6beta-olide 88.24
C00011843 (+)-Caleine E
Calein E		 88.24
C00011982 [3aS-(3aalpha,4beta,5beta,6alpha,7abataethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 88.24
C00012191 Deoxyrupatoripicrin
Desoxyrupatoripicrin		 88.24
C00012299 Arcotiopicrin
Orientin (sesquiterpene)		 88.24
C00012339 Gochnatolide 88.24
C00013210 (-)-Eriolanin
Eriolanin
[3aalpha,4alpha,5(S*),7aalpha]-(-)- 2,3,3a,4,7,7a-Hexahydro-6-(hydroxymethyl)-5-(4-hydroxy-1-methylbutyl)-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid		 88.24
C00041951 Tuberospironine 88.24
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