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


and

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




INPUT WORD = C00021686 , 50% or more
[ Metabolite Name : Salonitenolide 8-O-angelate ]
Number of matched data : 59

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012174 Hallerin 100.00
C00011798 3-Epinobilin 96.08
C00011800 3-Dehydronobilin 96.08
C00012215 Wunderolide 96.08
C00021701 9beta-(2-Methyl butyryloxy)-costunolide 95.92
C00003339 Nobilin 94.12
C00012191 Deoxyrupatoripicrin
Desoxyrupatoripicrin		 94.12
C00011419 [R-[R*,R*-(Z,E,E,E)]]-1-(3,3-Dimethyloxiranyl)-9-hydroxy-3,7-dimethyl-3,5,7-nonatrienyl ester 2-methyl-2-butenoic acid 93.88
C00021702 9beta-Isovaleryloxy costunolide 93.88
C00012208 Grazielia acid 92.45
C00012258 Zoapatanolide A 92.45
C00011780 Mollisorin A 92.16
C00011816 8beta-(2-Methylbutanoyl)-14-hydroxy-1(10),4E,11(13)-germacratrien-12,6beta-olide 92.16
C00032954 Eupaglehnin C
(+)-Eupaglehnin C		 92.16
C00012848 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(2-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 91.84
C00003249 Deacetyleupaserrin
Desacetyleupaserrin		 90.57
C00003278 Eupatoriopicrin 90.57
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 90.57
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 90.57
C00012196 (-)-Ursiniolide D
Ursiniolide D		 90.57
C00012213 Germanin A 90.57
C00012256 Montafrusin
Montafrusin A		 90.57
C00012263 Gigantanolide A 90.57
C00012264 Gigantanolide B 90.57
C00023191 8beta-Tigloyloxy-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4E-11(13)-trien-6,12-olide 90.57
C00012103 Deltoidin A 90.38
C00012419 Pycnolide 90.38
C00012979 Chapinolin
[3aR-[3aalpha,4alpha(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.38
C00012983 Arturin
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.38
C00034402 8alpha-Angeloyloxytannunolide 90.00
C00012214 Glabratolide 89.80
C00012830 [2R-[2alpha,4aalpha,5beta(Z),8abeta]]-Decahydro-4a-methyl-alpha,8-bis(methylene)-5-[(2-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 89.80
C00012847 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(3-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 89.80
C00020106 [1S-[1alpha,2beta(Z),8aalpha]]-1,2,3,5,6,8a-Hexahydro-4,7-dimethyl-1-(1-methylethyl)-6-oxo-2-naphthalenyl ester 2-methyl-2-butenoic acid 89.80
C00021406 Lapidin 89.80
C00022074 (E,Z,E,Z)-6-Formyl-2,10,14-trimethyl-2,6,10,14-hexadecatetraenedioic acid 89.80
C00022087 13-Acetoxygeranyllinalol 89.80
C00042704 Lobophytol 89.80
C00042722 Mayolide A 89.80
C00042883 Pulicanadiene C
(-)-Pulicanadiene C		 89.80
C00045606 Acalycixeniolide I
(+)-Acalycixeniolide I		 89.80
C00046897 Sarcocrassolide
(+)-Sarcocrassolide		 89.80
C00050213 Sandensolide 89.80
C00011782 Mollisorin B 88.89
C00012082 Euperfolin 88.89
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		 88.89
C00042506 Eupakirunsin D
(-)-Eupakirunsin D		 88.89
C00003334 Molephantinin 88.68
C00011846 Trichomoriolide 88.68
C00011847 Eupachifolin A 88.68
C00011851 Acanthospermolide 88.68
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		 88.68
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		 88.68
C00012259 Zoapatanolide B 88.68
C00012260 Deoxytifruticin 88.68
C00012265 Gigantanolide C 88.68
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 88.68
C00029910 Carlaolide B 88.68
C00042504 Eupakirunsin B
(-)-Eupakirunsin B		 88.68
Page Top