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


and

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




INPUT WORD = C00045041 , 50% or more
[ Metabolite Name : Reissantin D ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013200 Mortonin B
(5alpha,5aalpha,6alpha,7beta,9beta,9aalpha)-7-(Acetyloxy)-6-(benzoyloxy)-5,5a,6,7,8,9-hexahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-5,9a-(epoxymethano)-1-benzoxepin-10-one		 94.03
C00045042 Reissantin E 91.78
C00013186 (-)-Malkangunin
Malkangunin
Malkanguniol 4-acetate 5-benzoate
[3S-(3alpha,4beta,5beta,5aalpha,6alpha,9alpha,9aalpha)]-Octahydro-5a-(hydroxymethyl)-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-4,5,6-triol 4-acetate 5-benzoate		 91.04
C00040565 Triptogelin G-2 91.04
C00012795 [1R-(1alpha,2beta,4abeta,5beta,6beta,8aalpha)]-Decahydro-8a-methyl-4-methylene-6-(1-methylethyl)-1,2,5-naphthalenetriol 1,2-diacetate 5-benzoate 88.06
C00013170 [3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-Octahydro-2,2,5a,9-tetramethyl-, 5,10-diacetate 6-benzoate H-3,9a-methano-1-benzoxepin-4,5,6,9,10-pentol 87.67
C00037396 Kuhistanicaol A
(+)-Kuhistanicaol A		 86.96
C00013178 (+)-Triptofoldin B
TWHR 2
Triptofoldin B
Triptofordin B
[3R-(3alpha,5beta,5aalpha,6alpha,9beta,9aalpha,10R*)]-Octahydro-2,2,5a,9-tetramethyl-, 5,6-dibenzoate 2H-3,9a-methano-1-benzoxepin-5,6,9,10-tetrol		 85.53
C00013180 Mortonol A
[3S-(3alpha,5beta,5aalpha,6alpha,9beta,9aalpha)]-5,6-bis(Benzoyloxy)octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-10-one		 85.53
C00036773 Assafoetidnol B
(+)-Assafoetidnol B		 85.51
C00046152 Milolide B
(+)-Milolide B		 85.51
C00049871 Excavatolide E
(+)-Excavatolide E		 85.51
C00036100 Cornutin F
(+)-Cornutin F		 85.29
C00048489 Neocaesalpin Q
(+)-Neocaesalpin Q		 85.29
C00012066 Ligularinone A 85.07
C00012075 Cinnamoylepoxyechinadiol 85.07
C00012768 Rupestrol cinnamate 85.07
C00021408 Palliferinin 85.07
C00024033 Scoparic acid A 85.07
C00030524 iso-Dulcinol 85.07
C00045063 Scopanolal
(-)-Scopanolal		 85.07
C00046851 Phyllaemblic acid
(+)-Phyllaemblic acid		 85.07
C00047532 Oligandriortholactone
(+)-Oligandriortholactone		 85.07
C00013188 [3R-[3alpha,5beta,5aalpha,6alpha(E),7alpha,9alpha,9aalpha]]-5,7-bis(Acetyloxy)octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-6-yl ester 3-phenyl-2-propenoic acid 84.93
C00021415 Lapidolidin 84.93
C00011060 Lactiflorin 84.51
C00033412 Taxumairol X
(+)-Taxumairol X		 84.51
C00013174 Vaalens 5
[3R-[3alpha,5beta(E),5aalpha,6alpha,9beta,9aalpha,10R*]]-10-(Acetyloxy)octahydro-9-hydroxy-6-[(hydroxyacetyl)oxy]-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-phenyl-2-propenoic acid		 84.42
C00037891 Taxuyunnanine P 84.29
C00013181 Eumaitenin
[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]-4,6,10-tris(Acetyloxy)octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-furancarboxylic acid		 84.00
C00011994 Zinaflorin I 83.82
C00013098 Vernodesmin
[3aR-(3aalpha,4alpha,5aalpha,6beta,9beta,9aalpha,9bbeta,12R*)]-Octahydro-6,12-dihydroxy-3-methylene-2-oxo-9-phenyl-6H-5a,9-propano-2H-furo[2,3-f][2]benzopyran-4-yl ester 2-methyl-2-propenoic acid		 83.82
C00031934 Junceellolide I
(-)-Junceellolide I		 83.82
C00042257 Australin B
(-)-Australin B		 83.82
C00011872 Cordifolia 55 83.58
C00012064 [1R-[1R*,4R*,6S*(Z),9R*,10R*(Z),11R*]]-[9-(1-Hydroxy-1-methylethyl)-1-methyl-10-[(2-methyl-1-oxo-2-butenyl)oxy]-5,12-dioxatricyclo[9.1.0.04,6]dodec-6-yl]methyl ester 2-methyl-2-butenoic acid 83.58
C00012794 Ivanuol
[1R-(1alpha,2beta,4abeta,5beta,6beta,8aalpha)]-Decahydro-8a-methyl-4-methylene-6-(1-methylethyl)-1,2,5-naphthalenetriol 2-acetate 5-benzoate		 83.58
C00012826 [1R-[1alpha(E),2alpha,4abeta,5beta,8alpha,8aalpha]]- 1,2,3,4,4a,5,8,8a-Octahydro-8-hydroperoxy-5-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenyl ester 3-phenyl-2-propenoic acid 83.58
C00015514 Rubiginone I 83.58
C00021460 Melledonol 83.58
C00021466 Melledonal B 83.58
C00021765 Dunnianin 83.58
C00028780 Oximidine I 83.58
C00030160 Dulcinol
Scopadulciol		 83.58
C00033692 Campyloside A 83.58
C00038620 Bonducellpin G
(+)-Bonducellpin G		 83.58
C00038820 Coelovirin B
(-)-Coelovirin B		 83.58
C00038908 Cytochalasin Z10 83.58
C00038909 Cytochalasin Z11 83.58
C00040871 Angustisepalin
(-)-Angustisepalin		 83.58
C00042557 Glaucolide K
(-)-Glaucolide K		 83.58
C00044731 Dulcidiol
(-)-Dulcidiol		 83.58
C00044732 Dulcinol
Scopadulciol		 83.58
C00049432 Bipinnatin G 83.58
C00050338 Cardivin C 83.58
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