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


and

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




INPUT WORD = C00012985 , 50% or more
[ Metabolite Name : (+)-Tirotundifolin E , Tirotundifolin E , Dodecahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2,3-dihydroxy-2-methylbutanoic acid ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012984 (+)-Tirotundifolin A
Tirotundifolin A		 96.43
C00037470 Malacitanolide
(+)-Malacitanolide		 94.83
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		 94.64
C00003206 Acroptilin 92.98
C00012320 (+)-Lychnostatin 2
Lychnostatin 2		 92.98
C00040771 15-Hydroxyeremantholide B 92.98
C00003226 Budlein A 92.86
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 92.86
C00012110 Punctaliatrin
Punctatin
Punctatin		 92.86
C00012976 (+)-Tirotundifolin C
Tirotundifolin C
(3aR,4R,5aR,6R,9aS,9bR)-[partial]- 2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 92.86
C00012987 Trichomatolide E
[3aR-[3aalpha,4beta(E),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-(hydroxymethyl)-2-butenoic acid		 92.86
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		 92.86
C00020489 Eupahakonin A 92.86
C00023190 8beta-(4'-hydroxytigloyloxy)-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4Z,11(13)-trien-6,12-olide 92.86
C00011740 Lacinolide B 91.38
C00020441 Chlorohyssopifolin E 91.38
C00042358 Cebellin J 91.38
C00012092 Lychnophorolide A
Centratherin		 91.23
C00012861 Carmanin
[1R-(1alpha,2beta,3alpha,4abeta,5beta,8alpha,8aalpha)]-8-formyldecahydro-1,5-dihydroxy-3-[[2-(hydroxymethyl)-1-oxo-2-propenyl]oxy]-4a-methyl-alpha-methylene-2-naphthaleneacetic acid methyl ester		 91.23
C00020702 [3aR-[3aalpha,4beta(S*),6alpha,6aalpha,7beta,7abeta,8abeta,8balpha,8cbeta]]-Dodecahydro-6,7-dihydroxy-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid 91.23
C00003232 (+)-Cnicin
Cnicin		 91.07
C00003271 Eupahyssopin 91.07
C00003293 Goyazensolide 91.07
C00003384 Vernodalin 91.07
C00011888 [3aS-(3aR*,4S*,6R*,9S*,10R*,11aS*)]-9-Ethoxydodecahydro-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-propanoic acid 91.07
C00012058 (+)-20-Hydroxyelemajurinelloide 91.07
C00012116 (-)-Lychnopholide
Lychnopholide		 91.07
C00012153 (-)-Argophyllone B
Argophyllone B		 91.07
C00012155 Viguilenin 91.07
C00012196 (-)-Ursiniolide D
Ursiniolide D		 91.07
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 91.07
C00012403 Eremantholide B 91.07
C00012956 Tanapsin
[3aR-[3aalpha,4alpha(Z),4aalpha,5beta,8beta,8abeta,9abeta]]-Dodecahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 91.07
C00012959 Decipienin B
[1aS-[1aalpha,1balpha,2aalpha,2balpha,4aalpha,5alpha(Z),7aalpha,7bbeta,7calpha]]-Dodecahydro-2b,5,7c-trimethyl-6-oxobisoxireno[5,6:7,8]naphtho[1,2-b]furan-5-yl ester 2-methyl-2-butenoic acid		 91.07
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		 91.07
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		 91.07
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		 91.07
C00020437 Chlororepdiolide
Cebellin E		 91.07
C00020438 Repensolide 91.07
C00020496 Eupahakonin B 91.07
C00020505 Epicentaurepensin
Linichlorin B		 91.07
C00020595 Janerin 91.07
C00020737 Repin 91.07
C00030468 Hemistepsin 91.07
C00042505 Eupakirunsin C
(-)-Eupakirunsin C		 91.07
C00043499 Eupachinilide H
(-)-Eupachinilide H		 91.07
C00012319 (+)-Lychnostatin 1
Lychnostatin 1		 89.83
C00003230 Centaurepensin
Chlorohyssopifolin A		 89.66
C00011873 Sphaerocephalin 89.66
C00012702 Pluchecinin 89.66
C00023183 Eupachinilide C 89.66
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