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


and

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




INPUT WORD = C00012641 , 50% or more
[ Metabolite Name : (3alpha,4beta)-4,15-bis(Acetyloxy)-12,13-epoxy-3-hydroxytrichothec-9-en-8-one ]
Number of matched data : 60

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012613 Neosolaniol
Neozolaniol
Solaniol
Solaniol
(3alpha,4beta,8alpha)-12,13-Epoxy-trichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate		 98.25
C00012639 Isoneosolaniol
NT 1
Toxin NT 1
Toxin T 1		 98.25
C00012633 (3alpha,4beta,7alpha,8alpha)-12,13-Epoxytrichothec-9-ene-3,4,7,8,15-pentol 4,15-diacetate 96.55
C00003129 Diacetoxyscirpenol 96.49
C00012636 (3alpha,4beta,7alpha)12,13-Epoxy-trichothec-9-ene-3,4,7,15-tetrol 4,15-diacetate 96.49
C00012635 Nivalenol 4,15-diacetate
Nivalenol diacetate
Saubinin I
12,13-Epoxy-3a,4b,7a,15-tetrahydroxytrichothec-9-en-8-one 4,15-diacetate		 94.92
C00012640 Deacetyl HT 2 toxin
T 2 triol
Toxin T 2 triol
Toxin T 3
12,13-Epoxy-trichothec-9-ene-3alpha,4beta,8alpha,15-tetrol 8-isovalerate		 94.74
C00012630 4,15-Diacetylverrucarol
Antibiotic A 2
Di-O-acetylverrucarol		 92.98
C00012631 (+)-Calonectrin
Calonectrin		 91.23
C00046956 Trichothecinol A
(+)-Trichothecinol A		 91.23
C00012614 8-Acetylneosolaniol
Neosoloaniol monoacetate		 90.48
C00012632 Verrol (terpene)
[4beta,15(E)]-15-(5-Hydroxy-3-methyl-2-pentenoate) 12,13-epoxytrichothec-9-ene-4,15-diol		 89.47
C00012634 Fusarenone X 89.47
C00012638 15-Deacetylneosolaniol
Toxin NT 2		 89.47
C00012650 Sporotrichiol 89.47
C00012651 Toxin HT 2 88.89
C00003196 Trichothecin 87.72
C00021148 Spathulin 87.72
C00033648 Anthemolide D
(+)-Anthemolide D		 87.72
C00012032 Zinaflavin E 85.96
C00012643 15-Acetoxyscirpen-3,4-diol
15-Acetoxyscirpenol
15-Acetylscirpenetriol
15-Mono-O-acetylscirpenol
15-O-Acetylscirpenetriol
4-Deacetylanguidin		 85.96
C00042271 Babylin B 85.96
C00011873 Sphaerocephalin 84.48
C00000228 Gibberellin A93
GA93		 84.21
C00011988 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha(Z),7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 84.21
C00012029 (+)-Zinaflavin C
Zinaflavin C		 84.21
C00012145 Tithonin 84.21
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 84.21
C00012242 [3aR-(3aR*,4S*,5R*,6E,10S*,11R*,11aS*)]-2,3,3a,4,5,8,9,10,11,11a-Decahydro-5,10,11-trihydroxy-6,10-dimethyl-3-methylene-2,9-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid 84.21
C00012647 [4beta(Z)]-12,13-epoxytrichothec-9-en-4-ol 2-butenoate 84.21
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		 84.21
C00015444 Flagranone B 84.21
C00020489 Eupahakonin A 84.21
C00021059 Gaillardipinnatin 84.21
C00021072 Inuchinenolide C 84.21
C00021172 4-Acetylchamissonolide 84.21
C00021992 Punctaporonin C 84.21
C00033933 Hydruntinolide A
(-)-Hydruntinolide A		 84.21
C00037827 Sipaucin C 84.21
C00038971 Dendronpholide E
(-)-Dendronpholide E
Sinulaflexiolide G
(-)-Sinulaflexiolide G		 84.21
C00042503 Eupakirunsin A
(-)-Eupakirunsin A		 84.21
C00042917 Rhodomollein XVIII
(-)-Rhodomollein XVIII		 84.21
C00043147 11alpha-Hydroxypoststerone
(+)-11alpha-Hydroxypoststerone		 84.21
C00043866 Rhodojaponin VI 84.21
C00044336 Synargentolide C
(+)-Synargentolide C		 84.21
C00044338 Synargentolide E
(+)-Synargentolide E		 84.21
C00012648 Trichodermadiene
[4beta[2Z,4E,5(2R,3R)]]-12,13-Epoxy-trichothec-9-en-4-ol 5-(3-methyloxiranyl)-2,4-pentadienoate		 83.33
C00000263 Podolactone A 83.05
C00012416 Salvifoliolide 82.76
C00017441 [4S-[4alpha,4aalpha,5alpha,6alpha(Z),8aalpha,9abeta]]-2,4,4a,5,6,7,8,8a,9,9a-Decahydro-4,8a-dihydroxy-9a-methoxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid 82.76
C00020460 Eupachifolin E 82.76
C00021084 6-Acetoxy-7-hydroxymyrcene-7-O-beta-D-glucopyranoside-2'-O-acetate 82.76
C00021376 Pretoxin 82.76
C00022397 Coleonol D
Forskolin F		 82.76
C00029570 6alpha-Hydroxyadoxoside 82.76
C00033649 Anthemolide E 82.76
C00035610 Epoxyisolinearol 82.76
C00037470 Malacitanolide
(+)-Malacitanolide		 82.76
C00037757 Ruwenine
(-)-Ruwenine		 82.76
C00040760 10-Hydroxycornin
(-)-10-Hydroxycornin		 82.76
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