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


and

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





INPUT WORD = C00012316 , 50% or more
[ Metabolite Name : [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 ]
Number of matched data : 61

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003338 Niveusin C 96.43
C00012136 Tifruticin 96.43
C00012301 [3aR-[3aR*,4R*(Z),6S*,9R*,10E,11aR*]]-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-methyl-2-butenoic acid
3alpha-Hydroxytrichomoriolide
96.36
C00012240 [3aS-[3aR*,4R*(Z),5R*,6R*,9S*,10E,11aS*]]-2-Methyl-, 2,3,3a,4,5,6,7,8,9,11a-decahydro-5,6,9-trihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-butenoic acid 94.74
C00003226 Budlein A 94.64
C00023260 9beta-Hydroxyatripliciolide-8-O-angelate 94.64
C00042507 Eupakirunsin E
(-)-Eupakirunsin E
94.64
C00011846 Trichomoriolide 94.55
C00012116 (-)-Lychnopholide
Lychnopholide
94.55
C00012304 [3aR-[3aR*,4R*(Z),6S*,9S*,10Z,11aR*]]-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-methyl-2-butenoic acid 94.55
C00012403 Eremantholide B 94.55
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
94.55
C00042506 Eupakirunsin D
(-)-Eupakirunsin D
94.55
C00012416 Salvifoliolide 93.10
C00012092 Lychnophorolide A
Centratherin
92.98
C00020698 Agriantholide 92.98
C00012145 Tithonin 92.86
C00012153 (-)-Argophyllone B
Argophyllone B
92.86
C00029417 1beta-Methoxydiversifolin 92.86
C00039366 Helivypolide E 92.86
C00000168 1beta,10alpha-Epoxy-8beta,14-dihydroxy-4E,11(13)-germacradien-12,6-olide 92.73
C00000235 Heliangine 92.73
C00003398 Zexbrevin B 92.73
C00011844 Calein F
Caleine F
92.73
C00011867 (Z,Z)-Heliangin
Leptocarpin
92.73
C00011871 Cordifolia 54 92.73
C00012084 (-)-Blumealactone A
Blumealactone A
92.73
C00012114 Ladibranolide 92.73
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
92.73
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
92.73
C00012258 Zoapatanolide A 92.73
C00012260 Deoxytifruticin 92.73
C00012270 Jurineolide 92.73
C00012300 Resinosolide 92.73
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
92.73
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
92.73
C00036422 17,18-Dehydroviguiepinin
(-)-17,18-Dehydroviguiepinin
92.73
C00039365 Helivypolide D 92.73
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin
92.73
C00042504 Eupakirunsin B
(-)-Eupakirunsin B
92.73
C00012134 Niveusin A 91.38
C00012137 15-Hydroxy-3-dehydrotifruticin 91.38
C00011744 Cordifene
Erlancorin
91.23
C00011750 Liscundin 91.23
C00012413 8beta-Tigloyloxy-2,3-seco-4Z,11(13)-heliangadiene-3,10beta:6,12-diolid-2-oic acid 91.23
C00020574 9-beta-Hydroxy-8beta-tiglinoyloxy-2-oxo-ludartin 91.23
C00020894 2alpha-Tigloyloxydugaldiolide 91.23
C00040771 15-Hydroxyeremantholide B 91.23
C00011990 [3aS-[3aalpha,4beta(Z),5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 91.07
C00012088 Isocentratherin 91.07
C00012090 Lobatin B 91.07
C00012093 Lychnophorolide B 91.07
C00012147 Niveusin B 91.07
C00012152 Argophyllin B 91.07
C00012155 Viguilenin 91.07
C00012985 (+)-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
91.07
C00020489 Eupahakonin A 91.07
C00020877 [3aR-(3aalpha,4beta,6beta,6aalpha,9aalpha,9bbeta)]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-6,8-dihydroxy-6,9-dimethyl-3-methylene-2,7-dioxoazuleno[4,5-b]furan-4-yl ester 2-methyl-2-butenoic acid 91.07
C00023189 3-Deacetyleupalinin A 91.07
C00036423 1alpha,4alpha,10alpha-Trihydroxy-9alpha-angeloyloxyguaia-2,11(13)-dien-12,6alpha-olide 91.07
C00042505 Eupakirunsin C
(-)-Eupakirunsin C
91.07
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