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


and

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





INPUT WORD = C00003129 , 50% or more
[ Metabolite Name : Diacetoxyscirpenol ]
Number of matched data : 86

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012636 (3alpha,4beta,7alpha)12,13-Epoxy-trichothec-9-ene-3,4,7,15-tetrol 4,15-diacetate 96.49
C00012641 (3alpha,4beta)-4,15-bis(Acetyloxy)-12,13-epoxy-3-hydroxytrichothec-9-en-8-one 96.49
C00012630 4,15-Diacetylverrucarol
Antibiotic A 2
Di-O-acetylverrucarol
96.36
C00012613 Neosolaniol
Neozolaniol
Solaniol
Solaniol
(3alpha,4beta,8alpha)-12,13-Epoxy-trichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate
94.74
C00012639 Isoneosolaniol
NT 1
Toxin NT 1
Toxin T 1
94.74
C00012631 (+)-Calonectrin
Calonectrin
94.55
C00012633 (3alpha,4beta,7alpha,8alpha)-12,13-Epoxytrichothec-9-ene-3,4,7,8,15-pentol 4,15-diacetate 93.10
C00012635 Nivalenol 4,15-diacetate
Nivalenol diacetate
Saubinin I
12,13-Epoxy-3a,4b,7a,15-tetrahydroxytrichothec-9-en-8-one 4,15-diacetate
91.53
C00012632 Verrol (terpene)
[4beta,15(E)]-15-(5-Hydroxy-3-methyl-2-pentenoate) 12,13-epoxytrichothec-9-ene-4,15-diol
91.23
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
91.23
C00046956 Trichothecinol A
(+)-Trichothecinol A
90.91
C00003196 Trichothecin 89.09
C00012634 Fusarenone X 89.09
C00012638 15-Deacetylneosolaniol
Toxin NT 2
89.09
C00012643 15-Acetoxyscirpen-3,4-diol
15-Acetoxyscirpenol
15-Acetylscirpenetriol
15-Mono-O-acetylscirpenol
15-O-Acetylscirpenetriol
4-Deacetylanguidin
89.09
C00012650 Sporotrichiol 89.09
C00012614 8-Acetylneosolaniol
Neosoloaniol monoacetate
87.30
C00012647 [4beta(Z)]-12,13-epoxytrichothec-9-en-4-ol 2-butenoate 87.27
C00037825 Sipaucin A 87.27
C00012651 Toxin HT 2 85.71
C00021148 Spathulin 85.71
C00033648 Anthemolide D
(+)-Anthemolide D
85.71
C00011375 (E,E,Z)-8,12-Bis(acetyloxy)-10-[(acetyloxy)methyl]-2,6-dimethyl-2,6,10-dodecatrienal 85.45
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
85.45
C00021059 Gaillardipinnatin 85.45
C00021072 Inuchinenolide C 85.45
C00021156 Tetraneurin F 85.45
C00021160 Tetraneurin C 85.45
C00021172 4-Acetylchamissonolide 85.45
C00021178 Britanin(-)-
Britannin
85.45
C00033933 Hydruntinolide A
(-)-Hydruntinolide A
85.45
C00049917 10-epi-Olguine 85.45
C00011873 Sphaerocephalin 84.48
C00011858 Peroxysachalinin 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
C00020445 Episolstitiolide 84.21
C00042271 Babylin B 84.21
C00012661 Trichoverrol A
[4b(2Z,4E,6S,7S)]-4-(6,7-dihydroxy-2,4-octadienoate) 12,13-Epoxy-trichothec-9-ene-4,15-diol
84.13
C00012665 Trichoverrol B
[4beta(2Z,4E,6S,7R)]-12,13-Epoxytrichothec-9-ene-4,15-diol 4-(6,7-dihydroxy-2,4-octadienoate)
84.13
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 83.93
C00017243 Antibiotic DT 136B
Cochleamycin B
DT 136B
83.93
C00022262 Coleonol E 83.93
C00022264 1,9-Dideoxyforskolin 83.93
C00047701 Ailanquassin A
(+)-Ailanquassin A
83.93
C00003284 Fastigilin B 83.64
C00003285 Fastigilin C 83.64
C00003293 Goyazensolide 83.64
C00003336 Multiradiatin 83.64
C00003384 Vernodalin 83.64
C00011976 11,13-Dehydromelitensin diacetate 83.64
C00011989 [3aS-[3aalpha,4beta,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-propenoic acid 83.64
C00011991 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid 83.64
C00011996 Zempoalin C 83.64
C00012060 Verafinin C 83.64
C00012061 11,13-Dihydrovernodalin 83.64
C00012086 [3aS-(3aR*,4R*,5R*,6S*,10R*,11aS*)]-2,3,3a,4,5,6,7,10,11,11a-Decahydro-5-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid 83.64
C00012300 Resinosolide 83.64
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
83.64
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 83.64
C00012418 Trichogoniolide 83.64
C00012629 15-Deacetylcalonectrin
15-Decalonectrin
15-Desacetylcalonectrin
15-O-Deacetylcalonectrin
83.64
C00016541 XR 368
Xenovulene A
83.64
C00020595 Janerin 83.64
C00020601 Christinine 83.64
C00020850 Acrorepiolide 83.64
C00021076 Cumanin diacetate 83.64
C00021165 Hymenograndin 83.64
C00021690 Hysterin acetate 83.64
C00022247 Cordobic acid 18-acetate 83.64
C00022345 3-Acetylvarodiol 83.64
C00022491 3-Oxo-18-acetoxy-8(17),13Z-labdadien-15-oic acid 83.64
C00023535 Teuchamaedrin C 83.64
C00030024 Creoside IV 83.64
C00030361 Gaudichanolide A 83.64
C00030653 Leucasdin B
(-)-Leucasdin B
83.64
C00032957 Eupaglehnin F 83.64
C00033460 Turpinionoside C
(-)-Turpinionoside C
83.64
C00033605 9alpha-Acetoxycumambrin A
(+)-9alpha-Acetoxycumambrin A
83.64
C00035782 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide 83.64
C00036422 17,18-Dehydroviguiepinin
(-)-17,18-Dehydroviguiepinin
83.64
C00038801 Clavigerin A 83.64
C00041071 Neurolenin D 83.64
C00041723 Parritadial 83.64
C00042914 Rhodomollein XV
(+)-Rhodomollein XV
83.64
C00043625 Kalmanol 83.64
C00047683 6alpha-Hydroxyeurycolactone E 83.64
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