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


and

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




INPUT WORD = C00028975 , 50% or more
[ Metabolite Name : Scutebarbatine A ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029592 7-O-Nicotinoylscutebarbatine H 93.26
C00031326 Scutebarbatine C
(-)-Scutebarbatine C		 92.05
C00031328 Scutebarbatine E
(-)-Scutebarbatine E		 90.91
C00031335 Scutebarbatine L
(-)-Scutebarbatine L		 89.89
C00031327 Scutebarbatine D
(-)-Scutebarbatine D		 89.77
C00031334 Scutebarbatine K
(-)-Scutebarbatine K		 87.21
C00047687 6-O-Acetylscutehenanine A
(-)-6-O-Acetylscutehenanine A		 87.21
C00029582 6-O-Nicotinoyl-7-O-acetylscutebarbatine G 86.32
C00035055 Barbatin A
(-)-Barbatin A		 85.39
C00050229 Scupontin G
(-)-Scupontin G		 85.39
C00035056 Barbatin B
(-)-Barbatin B		 84.27
C00031329 Scutebarbatine F
(-)-Scutebarbatine F		 83.72
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		 82.22
C00001968 Celapanine 81.40
C00013168 [3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-5-(Acetyloxy)-6-(benzoyloxy)octahydro-4,9-dihydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-10-yl ester 3-pyridinecarboxylic acid 81.40
C00013183 Deacetylcelapanigine
Celapagine
6-(Acetyloxy)-10-(benzoyloxy)octahydro-4-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid		 81.40
C00031915 Isovouacapenol E
(-)-Isovouacapenol E		 81.40
C00013160 Rzedowskin D
[3R-[3alpha,5beta,5aalpha,6alpha(E),7beta,9beta,9aalpha,10R*]]-5-(Acetyloxy)octahydro-7,9-dihydroxy-2,2,5a,9-tetramethyl-6-[(1-oxo-3-phenyl-2-propenyl)oxy]-2H-3,9a-methano-1-benzoxepin-10-yl ester 3-pyridinecarboxylic acid		 80.68
C00013176 Ejap 14
[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]-4,6,10-tris(Acetyloxy)-5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid		 80.23
C00024040 Scuterivulactone C2 3-O-acetate 80.23
C00041118 Scutalpin J 80.23
C00041120 Scutalpin N
(-)-Scutalpin N		 80.23
C00016204 Pyripyropene N 79.07
C00024036 Scuterivulactone A 79.07
C00024859 Cossonine
(+)-Cossonine		 79.07
C00031332 Scutebarbatine I
(-)-Scutebarbatine I		 79.07
C00038782 Circinasine D 79.07
C00046392 Scuterulein A
(-)-Scuterulein A		 79.07
C00046394 Scuterulein C
(-)-Scuterulein C		 79.07
C00013167 Cathedulin 8
Cathedulin E 8
Catheduline E 8
(3alpha,4alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha)-[6,7-bis(Acetyloxy)-5-(benzoyloxy)octahydro-4-hydroxy-2,2,9-trimethyl-5aH-3,9a-methano-1-benzoxepin-5a-yl]methyl ester 3-pyridinecarboxylic acid		 78.89
C00016858 FO 1289B
Pyripyropene B		 78.89
C00031269 Salasol B 78.89
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		 78.41
C00016857 (+)-Pyripyropene A
FO 1289A
Pyripyropene A		 78.41
C00031503 14-O-Anisoylneoline 78.41
C00039100 Elaeodendroside F 78.41
C00039101 Elaeodendroside G 78.41
C00047910 Granatumin C
(+)-Granatumin C		 78.16
C00013172 Acetyleumaitenol
[3R-(3alpha,4alpha,5beta,8aalpha,6alpha,9beta,9aalpha,10R*)]-4,6-bis(Acetyloxy)octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5,10-diyl ester 3-furancarboxylic acid		 77.91
C00024038 Scuterivulactone C1 77.91
C00024039 Scuterivulactone C2 77.91
C00039538 Kadsuphilactone A
(+)-Kadsuphilactone A		 77.91
C00046248 Orbiculin E
(+)-Orbiculin E		 77.91
C00047421 Cineracipadesin D
(-)-Cineracipadesin D		 77.91
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 77.78
C00039102 Elaeodendroside T
(+)-Elaeodendroside T		 77.78
C00042996 Severinolide
(+)-Severinolide		 77.53
C00048515 Pulcherrimin C 77.53
C00041119 Scutalpin L 77.32
C00015121 Phenylpyropene A 77.27
C00016203 Pyripyropene M 77.27
C00035734 Quivisianthone 77.27
C00046246 Orbiculin A 77.27
Page Top