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


and

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




INPUT WORD = C00012638 , 50% or more
[ Metabolite Name : 15-Deacetylneosolaniol , Toxin NT 2 ]
Number of matched data : 86

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012634 Fusarenone X 94.34
C00012643 15-Acetoxyscirpen-3,4-diol
15-Acetoxyscirpenol
15-Acetylscirpenetriol
15-Mono-O-acetylscirpenol
15-O-Acetylscirpenetriol
4-Deacetylanguidin		 94.12
C00046956 Trichothecinol A
(+)-Trichothecinol A		 92.45
C00003196 Trichothecin 92.16
C00003167 Nivalenol 90.20
C00012629 15-Deacetylcalonectrin
15-Decalonectrin
15-Desacetylcalonectrin
15-O-Deacetylcalonectrin		 90.20
C00012639 Isoneosolaniol
NT 1
Toxin NT 1
Toxin T 1		 89.47
C00012641 (3alpha,4beta)-4,15-bis(Acetyloxy)-12,13-epoxy-3-hydroxytrichothec-9-en-8-one 89.47
C00003129 Diacetoxyscirpenol 89.09
C00012630 4,15-Diacetylverrucarol
Antibiotic A 2
Di-O-acetylverrucarol		 88.68
C00012631 (+)-Calonectrin
Calonectrin		 88.68
C00003195 Trichodermin 88.24
C00012637 T 2 toxin tetraol
T-2 Tetraol
T-2 tetrol
Toxin T 2 tetraol
Toxin T 4
12,13-Epoxy-trichothec-9-ene-3alpha,4beta,8alpha,15-tetrol		 88.24
C00012647 [4beta(Z)]-12,13-epoxytrichothec-9-en-4-ol 2-butenoate 88.24
C00012613 Neosolaniol
Neozolaniol
Solaniol
Solaniol
(3alpha,4beta,8alpha)-12,13-Epoxy-trichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate		 87.72
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		 87.72
C00012650 Sporotrichiol 87.27
C00002720 5-O-Caffeoylshikimic acid
5-O-caffeoylshikimic acid		 86.27
C00012030 (-)-Zinaflavin F
Zinaflavin F		 86.27
C00012645 Isotrichodermin 86.27
C00012633 (3alpha,4beta,7alpha,8alpha)-12,13-Epoxytrichothec-9-ene-3,4,7,8,15-pentol 4,15-diacetate 86.21
C00012636 (3alpha,4beta,7alpha)12,13-Epoxy-trichothec-9-ene-3,4,7,15-tetrol 4,15-diacetate 85.96
C00012635 Nivalenol 4,15-diacetate
Nivalenol diacetate
Saubinin I
12,13-Epoxy-3a,4b,7a,15-tetrahydroxytrichothec-9-en-8-one 4,15-diacetate		 84.75
C00021076 Cumanin diacetate 84.62
C00034780 9alpha-Acetoxyartecanin 84.62
C00003201 Vomitoxin 84.31
C00012642 Anguidol
Scirpenetriol
Scirpenol
Scirpentriol
12,13-Epoxy-trichothec-9-ene-3alpha,4beta,15-triol		 84.31
C00021175 Picrohelenin 84.31
C00029317 (2E,6Z)-8-beta-D-glucopyranosyloxy-2,6-dimethyl-2,6-octadienoic acid 84.31
C00030591 Kankanoside E
(-)-Kankanoside E		 84.31
C00040199 Salograviolide B 84.31
C00046299 Phyllaemblic acid B
(+)-Phyllaemblic acid B		 84.31
C00050060 Dihydroflexibilolide
(-)-Dihydroflexibilolide		 84.31
C00050099 Flexibilolide
(-)-Flexibilolide		 84.31
C00012300 Resinosolide 83.02
C00002080 Angularine 82.69
C00002112 Rosmarinine 82.69
C00011865 Erioflorin 82.69
C00020449 Ezoartemin 82.69
C00020454 Rupin B 82.69
C00020457 Yomogiartemin 82.69
C00020458 Yamayomoginin 82.69
C00021783 2beta,5alpha-Diacetoxy-9(12)-capnellene-8beta,10alpha-diol 82.69
C00021787 13beta,14-Diacetoxy-9(12)-capnellene-8beta,10alpha-diol 82.69
C00033609 9-O-Acetylanthemolide B 82.69
C00044334 Synargentolide A
(+)-Synargentolide A		 82.69
C00048232 Volvaltrate A 82.69
C00003216 Arctolide 82.35
C00003347 1-Peroxyferolide 82.35
C00010728 Villoside 82.35
C00011752 4,5-Dihydromelampodin B 82.35
C00011756 Millefin 82.35
C00011823 Idomain 82.35
C00011856 Tagitinin C 82.35
C00011983 [3aS-(3aalpha,4beta,5beta,6alpha,7alpha,7abeta)]-6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid 82.35
C00012056 Zinaflavin G 82.35
C00012330 Subcordatolide D 82.35
C00012359 Scandenolide 82.35
C00012365 Zeylanan
Zeylanane		 82.35
C00017325 Eremofortin D 82.35
C00020599 Artefransin 82.35
C00020705 Ezomontanin 82.35
C00020706 11,13-Dihydroezomontanin 82.35
C00020741 2-Acetylzafronic acid 82.35
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 82.35
C00020747 [1R-(1alpha,4alpha,4aalpha,6alpha,8aalpha)]-6-(Acetyloxy)-1,2,3,4,4a,5,6,8a-octahydro-4-hydroxy-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 82.35
C00020847 8alpha-Acetoxy-3alpha,4alpha,10beta-trihydroxy-1-guaien-12,6alpha-olide 82.35
C00020854 Solstitialin A 13-acetate 82.35
C00020860 9beta-Hydroxykandavanolide 82.35
C00021097 Parthoximenthine 82.35
C00021128 Arnicolide C 82.35
C00021129 Arnicolide D 82.35
C00021171 Chamissonolide 82.35
C00021177 6beta-Hydroxypulchellin 2-O-acetate 82.35
C00023697 (+)-O-Methyldihydrobotrydial 82.35
C00031529 1-O-beta-D-Glucopyranosylamplexine 82.35
C00033190 Merrilliortholactone
(-)-Merrilliortholactone		 82.35
C00033647 Anthemolide C 82.35
C00040198 Salograviolide A 82.35
C00041109 Rolinose
(+)-Rolinose		 82.35
C00042062 1beta,8alpha-Dihydroxyeremophil-7(11),9-dien-8beta,12-olide
(-)-1beta,8alpha-Dihydroxyeremophil-7(11),9-dien-8beta,12-olide		 82.35
C00042064 1-O-beta-D-Glucopyranosyl-4-epiamplexine
(-)-1-O-beta-D-Glucopyranosyl-4-epiamplexine		 82.35
C00044337 Synargentolide D 82.35
C00046383 Scabrolide A
(-)-Scabrolide A		 82.35
C00046384 Scabrolide B
(-)-Scabrolide B		 82.35
C00049182 Ipanguline D10 82.35
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