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


and

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




INPUT WORD = C00012613 , 50% or more
[ Metabolite Name : Neosolaniol , Neozolaniol , Solaniol , Solaniol , (3alpha,4beta,8alpha)-12,13-Epoxy-trichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate ]
Number of matched data : 66

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012641 (3alpha,4beta)-4,15-bis(Acetyloxy)-12,13-epoxy-3-hydroxytrichothec-9-en-8-one 98.25
C00012639 Isoneosolaniol
NT 1
Toxin NT 1
Toxin T 1		 96.49
C00012633 (3alpha,4beta,7alpha,8alpha)-12,13-Epoxytrichothec-9-ene-3,4,7,8,15-pentol 4,15-diacetate 94.83
C00003129 Diacetoxyscirpenol 94.74
C00012636 (3alpha,4beta,7alpha)12,13-Epoxy-trichothec-9-ene-3,4,7,15-tetrol 4,15-diacetate 94.74
C00012635 Nivalenol 4,15-diacetate
Nivalenol diacetate
Saubinin I
12,13-Epoxy-3a,4b,7a,15-tetrahydroxytrichothec-9-en-8-one 4,15-diacetate		 93.22
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		 92.98
C00012630 4,15-Diacetylverrucarol
Antibiotic A 2
Di-O-acetylverrucarol		 91.23
C00012631 (+)-Calonectrin
Calonectrin		 89.47
C00046956 Trichothecinol A
(+)-Trichothecinol A		 89.47
C00012614 8-Acetylneosolaniol
Neosoloaniol monoacetate		 88.89
C00012632 Verrol (terpene)
[4beta,15(E)]-15-(5-Hydroxy-3-methyl-2-pentenoate) 12,13-epoxytrichothec-9-ene-4,15-diol		 87.72
C00012634 Fusarenone X 87.72
C00012638 15-Deacetylneosolaniol
Toxin NT 2		 87.72
C00012650 Sporotrichiol 87.72
C00021148 Spathulin 87.72
C00042271 Babylin B 87.72
C00012651 Toxin HT 2 87.30
C00003196 Trichothecin 85.96
C00011744 Cordifene
Erlancorin		 85.96
C00012029 (+)-Zinaflavin C
Zinaflavin C		 85.96
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		 85.96
C00021072 Inuchinenolide C 85.96
C00021172 4-Acetylchamissonolide 85.96
C00033648 Anthemolide D
(+)-Anthemolide D		 85.96
C00043147 11alpha-Hydroxypoststerone
(+)-11alpha-Hydroxypoststerone		 85.96
C00000263 Podolactone A 84.75
C00021084 6-Acetoxy-7-hydroxymyrcene-7-O-beta-D-glucopyranoside-2'-O-acetate 84.48
C00021376 Pretoxin 84.48
C00022397 Coleonol D
Forskolin F		 84.48
C00029570 6alpha-Hydroxyadoxoside 84.48
C00040760 10-Hydroxycornin
(-)-10-Hydroxycornin		 84.48
C00003385 Vernodalol 84.21
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 84.21
C00011993 Zinaflorin II 84.21
C00012031 Zinaflavin D 84.21
C00012032 Zinaflavin E 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
C00012643 15-Acetoxyscirpen-3,4-diol
15-Acetoxyscirpenol
15-Acetylscirpenetriol
15-Mono-O-acetylscirpenol
15-O-Acetylscirpenetriol
4-Deacetylanguidin		 84.21
C00012958 Cyclocratystyolide
[2R-(2alpha,3abeta,5beta,6abeta,7aalpha,10abeta,10balpha,10cbeta)]-2-(Acetyloxy)decahydro-5-methoxy-5,10c-dimethyl-1,8-bis(methylene)-furo[3',2':3,4]naphtho[1,8-de][1,3]dioxin-9(1H)-one		 84.21
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		 84.21
C00021059 Gaillardipinnatin 84.21
C00021076 Cumanin diacetate 84.21
C00021145 Parthoxetin 84.21
C00021156 Tetraneurin F 84.21
C00021160 Tetraneurin C 84.21
C00021178 Britanin(-)-
Britannin		 84.21
C00021992 Punctaporonin C 84.21
C00022262 Coleonol E 84.21
C00022264 1,9-Dideoxyforskolin 84.21
C00023190 8beta-(4'-hydroxytigloyloxy)-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4Z,11(13)-trien-6,12-olide 84.21
C00033933 Hydruntinolide A
(-)-Hydruntinolide A		 84.21
C00035790 3,15-Di-O-acetyl-9beta-hydroxyamphoricarpolide 84.21
C00036396 10-Acetylaucubin 84.21
C00039200 Excisusin C
(-)-Excisusin C		 84.21
C00039202 Excisusin E
(-)-Excisusin E		 84.21
C00041359 Asbestinin-26
(-)-Asbestinin-26		 84.21
C00041455 Crassocolide A
(+)-Crassocolide A		 84.21
C00041723 Parritadial 84.21
C00042210 Albopilosin D
(-)-Albopilosin D		 84.21
C00042917 Rhodomollein XVIII
(-)-Rhodomollein XVIII		 84.21
C00043866 Rhodojaponin VI 84.21
C00044336 Synargentolide C
(+)-Synargentolide C		 84.21
C00044338 Synargentolide E
(+)-Synargentolide E		 84.21
C00047701 Ailanquassin A
(+)-Ailanquassin A		 84.21
C00049917 10-epi-Olguine 84.21
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