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


and

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




INPUT WORD = C00011823 , 50% or more
[ Metabolite Name : Idomain ]
Number of matched data : 63

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011803 3beta-Acetoxyhaageanolide acetate 96.08
C00003215 Arctiopicrin 94.12
C00003341 Onopordopicrin 94.12
C00011804 Sintenin 94.12
C00011814 Zexbrevin D 94.12
C00011805 Artemisiaglaucolide 92.16
C00011976 11,13-Dehydromelitensin diacetate 92.16
C00012962 Armexin
[3aS-(3aalpha,5abeta,6alpha,8alpha,9balpha)]-6,8-bis(acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 90.38
C00020506 8alpha-Acetoxyzaluzanin D 90.38
C00021092 Ligulatin C 90.38
C00021690 Hysterin acetate 90.38
C00003229 Chamissonin diacetate 90.20
C00011377 6,10-Bis(acetoxymethyl)-12-hydroxy-2-methyl-2,6,10-dodecatrienal 90.20
C00011756 Millefin 90.20
C00012045 Micordilin 90.20
C00012266 Pectorolide 90.20
C00012339 Gochnatolide 90.20
C00003232 (+)-Cnicin
Cnicin		 89.09
C00012104 Eupassopilin 88.89
C00020482 Breviarolide 88.89
C00021156 Tetraneurin F 88.89
C00033605 9alpha-Acetoxycumambrin A
(+)-9alpha-Acetoxycumambrin A		 88.89
C00035790 3,15-Di-O-acetyl-9beta-hydroxyamphoricarpolide 88.89
C00003278 Eupatoriopicrin 88.68
C00011860 (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 3-methylbutanoic acid 88.68
C00012249 [7S-(7R*,9R*,10E,11aS*)]-9-(acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,11a-hexahydro-7-hydroxy-10-methyl-6-methylenecyclodeca[b]furan-2(4H)-one
1lapha-Hydroxyafraglaucolide		 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
C00012103 Deltoidin A 88.46
C00021066 Pulchellin diacetate
Diacetylpulchellin		 88.46
C00021076 Cumanin diacetate 88.46
C00003339 Nobilin 88.24
C00011391 (E,E)-5-[4-(Acetyloxy)-2-methyl-2-butenyl]-3-[5-(acetyloxy)-4-methyl-3-pentenyl]-2(5H)-furanone 88.24
C00011977 Isoarbutifolin 88.24
C00012299 Arcotiopicrin
Orientin (sesquiterpene)		 88.24
C00020743 [1R-(1alpha,4beta,4abeta,6alpha,8aalpha)]-6-(Acetyloxy)-4-ethoxy-1,2,3,4,4a,5,6,8a-octahydro-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 88.24
C00021702 9beta-Isovaleryloxy costunolide 88.24
C00022677 14-Acetoxy-5alpha-hydroperoxy-isoalantolactone 88.24
C00045156 15-Isovaleroyloxycostunolide 88.24
C00020601 Christinine 87.27
C00011785 Ursiniolide C 87.04
C00013089 Eudesmaafraglaucolide
[5aR-(5aalpha,6alpha,8alpha,9abeta,9balpha)]-8-(Acetyloxy)-3-[(acetyloxy)methyl]-5,5a,6,7,8,9,9a,9b-octahydro-6-hydroxy-5a-methyl-9-methylenenaphtho[1,2-b]furan-2(4H)-one		 87.04
C00021072 Inuchinenolide C 87.04
C00021165 Hymenograndin 87.04
C00021172 4-Acetylchamissonolide 87.04
C00021178 Britanin(-)-
Britannin		 87.04
C00030653 Leucasdin B
(-)-Leucasdin B		 87.04
C00033933 Hydruntinolide A
(-)-Hydruntinolide A		 87.04
C00037825 Sipaucin A 87.04
C00003177 Rhipocephalin 86.79
C00003249 Deacetyleupaserrin
Desacetyleupaserrin		 86.79
C00011387 4-Acetoxyflexilin 86.79
C00011847 Eupachifolin A 86.79
C00011851 Acanthospermolide 86.79
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 86.79
C00012196 (-)-Ursiniolide D
Ursiniolide D		 86.79
C00012250 Achillolide B 86.79
C00012254 [7R-(7R*,9S*,10E,11aR*)]-9-(Acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,11a-hexahydro-7-hydroxy-10-methyl-6-methylenecyclodeca[b]furan-2(4H)-one
1beta-Hydroxyafraglaucolide		 86.79
C00012257 (+)-Montafrusin B
Montafrusin B		 86.79
C00012259 Zoapatanolide B 86.79
C00012268 (+)-Jurinelloide
Jurinelloide		 86.79
C00012276 Linearilobin F 86.79
C00012341 Ineupatorolide A 86.79
C00033835 Estafiatin 8-O-angelate 86.79
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