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


and

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




INPUT WORD = C00035955 , 50% or more
[ Metabolite Name : 6alpha-Acetoxy-9beta-benzoyloxy-1beta-cinnamoyloxy-8beta-(2-methylbutanoyloxy)-beta-dihydroagarofuran ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013148 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		 93.14
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		 91.84
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		 88.78
C00044981 Orthosiphol X
(-)-Orthosiphol X		 88.78
C00013136 Pringlein 87.76
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		 87.76
C00030237 Euphoscopin C 87.76
C00031269 Salasol B 87.76
C00039807 Mutangin 87.76
C00046246 Orbiculin A 87.76
C00044975 Orthosiphol O
(-)-Orthosiphol O		 87.25
C00045038 Reissantin A 86.73
C00041158 Taxchinin H 86.54
C00003430 Gnidicin 85.86
C00041146 Taxamedin A 85.86
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		 85.84
C00013134 (-)-Triptofordin C 2
Triptofordin C 2		 85.71
C00013135 (-)-Triptofordin C 1
Triptofordin C 1		 85.71
C00013182 Celapanigine
Celapagine 4-acetate
4,6-bis(Acetyloxy)-10-(benzoyloxy)octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid		 85.71
C00043421 Cryptophycin 38 85.71
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		 85.58
C00032067 Neoorthosiphol B
(+)-Neoorthosiphol B		 85.58
C00033272 Orthosiphol A 85.29
C00033279 Orthosiphonone B 85.29
C00039218 Fokienagarofuran A 85.05
C00049519 Spicataxine
(+)-Spicataxine		 85.00
C00041147 Taxayuntin A 84.85
C00045290 Dantaxusin D
(+)-Dantaxusin D		 84.85
C00013163 Maymyrsine
[3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-6,10-bis(Acetyloxy)-7-(benzoyloxy)octahydro-5a-(hydroxymethyl)-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid		 84.69
C00041165 Taxine II 84.69
C00041191 Taxuspine H 84.69
C00049352 7,2'-Bisdeacetoxyaustropicatine
(+)-7,2'-Bisdeacetoxyaustropicatine
7,2'-Didesacetoxyaustrospicatine		 84.69
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		 84.62
C00044347 Taxuspinanane J 84.40
C00033278 Orthosiphonone A
(-)-Orthosiphonone A		 84.31
C00038166 15-Acetoxyorbiculin G 84.11
C00049531 Taxchinin M
(-)-Taxchinin M		 84.00
C00040812 2'-Hydroxy taxine II
(+)-2'-Hydroxy taxine II		 83.84
C00041164 Taxine I 83.84
C00049438 Comptonine
(+)-Comptonine		 83.84
C00013131 Celangulin 83.67
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		 83.67
C00013169 [3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-4,5-bis(Acetyloxy)-6-(benzoyloxy)octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-10-yl ester 3-pyridinecarboxylic acid 83.67
C00035149 Picroroside C
(-)-Picroroside C		 83.67
C00041166 Taxinine E 83.67
C00041188 Taxuspine C 83.67
C00048516 Pulcherrimin E 83.67
C00049410 10-Deacetyltaxinine B
(+)-10-Deacetyltaxinine B		 83.67
C00049418 CID is old! 83.67
C00032079 Norstaminol A
(-)-Norstaminol A		 83.65
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