"Twins" retrives similar metabolites in chemical structure.
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"Twins" retrives similar metabolites in chemical structure. |
| last update : 2020.01.06 |
| INPUT WORD = C00013148 , 50% or more |
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| [ Metabolite Name : Triptofordin D 2 , [3R-(3alpha,4alpha,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-4,10-bis(Acetyloxy)-5a-[(acetyloxy)methyl]-5-(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-6-yl ester 3-phenyl-2-propenoic acid ] | |
| Number of matched data : 57 | |
| CID | Metabolite Name | Structural formula | Metabolite Activity | Similarity (%) |
|---|---|---|---|---|
| C00013156 | Triptofordin D 1 [3R-(3alpha,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-10-(Acetyloxy)-5a-[(acetyloxy)methyl]-5-(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-4-oxo-2H-3,9a-methano-1-benzoxepin-6-yl ester 3-phenyl-2-propenoic acid |
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93.14 | C00035955 | 6alpha-Acetoxy-9beta-benzoyloxy-1beta-cinnamoyloxy-8beta-(2-methylbutanoyloxy)-beta-dihydroagarofuran |  |
93.14 | C00013144 | Celahin D Elat 5 [3R-(3alpha,4alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol 6,7,10-triacetate 4,5-dibenzoate |
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92.31 | C00013137 | Acetylpringleine [3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9beta,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,10-diacetate 5,7-dibenzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,9,10-pentol |
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92.16 | C00013138 | Euolalin [3R-[3alpha,5beta(S*),5aalpha,6alpha,7alpha,9beta,9aalpha,10R*]]-10-(Acetyloxy)-5a-[(acetyloxy)methyl]-6,7-bis(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 2-methylbutanoic acid |
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91.35 | C00033272 | Orthosiphol A |  |
91.18 | C00033274 | Orthosiphol F (-)-Orthosiphol F |
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91.18 | C00033279 | Orthosiphonone B |  |
91.18 | C00013150 | Triptofordinine A 2 [3R-[3alpha,4alpha,5alpha,5aalpha,6alpha(Z),9beta,9aalpha,10R*]]-10-(Acetyloxy)-5a-[(acetyloxy)methyl]-5-(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-6-[(1-oxo-3-phenyl-2-propenyl)oxy]-2H-3,9a-methano-1-benzoxepin-4-yl ester 3-pyridinecarboxylic acid |
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90.27 | C00039807 | Mutangin |  |
90.20 | C00032079 | Norstaminol A (-)-Norstaminol A |
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89.42 | C00032159 | Siphonol B (-)-Siphonol B |
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89.42 | C00032198 | Staminol B (-)-Staminol B |
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89.42 | C00046252 | Orthosiphol L (-)-Orthosiphol L |
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89.42 | C00013164 | Acetylmaymyrsine Maymyrsine acetate [3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-6,10-bis(Acetyloxy)-5a-[(acetyloxy)methyl]-7-(benzoyloxy)octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid |
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89.22 | C00045289 | Dantaxusin C |  |
89.22 | C00038166 | 15-Acetoxyorbiculin G |  |
88.79 | C00013129 | Maytolidine |  |
88.68 | C00033387 | Staminolactone A (-)-Staminolactone A |
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88.57 | C00033388 | Staminolactone B (-)-Staminolactone B |
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88.57 | C00013149 | Triptofordinine A 1 [3R-[3alpha,4alpha,5alpha,5aalpha,6alpha(E),9beta,9aalpha,10R*]]-10-(Acetyloxy)-5a-[(acetyloxy)methyl]-5-(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-6-[(1-oxo-3-phenyl-2-propenyl)oxy]-2H-3,9a-methano-1-benzoxepin-4-yl ester 3-pyridinecarboxylic acid |
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88.50 | C00032066 | Neoorthosiphol A (-)-Neoorthosiphol A |
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88.46 | C00013131 | Celangulin |  |
88.24 | C00013136 | Pringlein |  |
88.24 | C00036220 | Taxinine B |  |
88.24 | C00041146 | Taxamedin A |  |
88.24 | C00039218 | Fokienagarofuran A |  |
87.85 | C00041137 | Taxagifine |  |
87.50 | C00041158 | Taxchinin H |  |
87.50 | C00044976 | Orthosiphol R (-)-Orthosiphol R |
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87.50 | C00041186 | Taxuspine A |  |
87.27 | C00013130 | Ejap 6 |  |
87.25 | C00013134 | (-)-Triptofordin C 2 Triptofordin C 2 |
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87.25 | C00013135 | (-)-Triptofordin C 1 Triptofordin C 1 |
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87.25 | C00013154 | [3S-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10S*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-4,5,6,9,10-pentol, 5-acetate 4,6-dibenzoate |  |
87.25 | C00033273 | Orthosiphol B |  |
87.25 | C00040457 | Taxuspine J |  |
87.25 | C00044975 | Orthosiphol O (-)-Orthosiphol O |
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87.25 | C00038185 | 1alpha,2alpha-Diacetoxy-6beta,9beta,15-tribenzoyloxy-beta-dihydroagarofuran (+)-1alpha,2alpha-Diacetoxy-6beta,9beta,15-tribenzoyloxy-beta-dihydroagarofuran |
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86.92 | C00013145 | Ejap 4 [3R-(3alpha,4alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 4,6,7,10-tetraacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol |
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86.27 | C00031269 | Salasol B |  |
86.27 | C00037888 | Taxinine M |  |
86.27 | C00043169 | 2,7-Dideacetyltaxuspine X (+)-2,7-Dideacetyltaxuspine X |
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86.27 | C00049519 | Spicataxine (+)-Spicataxine |
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86.27 | C00049525 | Taxawallin A (+)-Taxawallin A |
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86.27 | C00044347 | Taxuspinanane J |  |
86.24 | C00041201 | Taxuspine T (-)-Taxuspine T |
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85.85 | C00049348 | 2alpha-Acetoxy-2',7-dideacetoxyaustrospicatine |  |
85.44 | C00032099 | Orthosiphol K (-)-Orthosiphol K |
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85.29 | C00033278 | Orthosiphonone A (-)-Orthosiphonone A |
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85.29 | C00036695 | Agnucastoside C (-)-Agnucastoside C |
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85.29 | C00041147 | Taxayuntin A |  |
85.29 | C00041166 | Taxinine E |  |
85.29 | C00043967 | Taxezopidine K (+)-Taxezopidine K |
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85.29 | C00045038 | Reissantin A |  |
85.29 | C00045290 | Dantaxusin D (+)-Dantaxusin D |
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85.29 | C00049537 | Taxuspinanane G |  |
85.29 |