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


and

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




INPUT WORD = C00014738 , 50% or more
[ Metabolite Name : Bicaryanone D , (2R,4bR,7aS,7bR,8R,11R,13aR,13bR,14R,15S)-2,3,4b,7a,7b,8,13b,14,15,18-Decahydro-2,11-diphenyl-11H-8,13a[2',3']-furanofuro[3',2':3,4]naphtho[1,2-b:7,8-b']dipyran-4,6,13,17(5H,12H)-tetrone ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00014735 Bicaryanone A
(2S,4bR,7aS,7bR,8R,11S,13aR,13bR,14R,15S)-2,3,4b,7a,7b,8,13b,14,15,18-Decahydro-2,11-diphenyl-11H-8,13a[2',3']-furanofuro[3',2':3,4]naphtho[1,2-b:7,8-b']dipyran-4,6,13,17(5H,12H)-tetrone		 96.74
C00014737 Bicaryanone C
(2S,4bR,7aS,7bR,8R,11R,13aR,13bR,14R,15S)-2,3,4b,7a,7b,8,13b,14,15,18-decahydro-2,11-Diphenyl-11H-8,13a[2',3']-furanofuro[3',2':3,4]naphtho[1,2-b:7,8-b']dipyran-4,6,13,17(5H,12H)-tetrone		 96.74
C00014736 Bicaryanone B
(2R,4bR,7aS,7bR,8R,11S,13aR,13bR,14R,15S)-2,3,4b,7a,7b,8,13b,14,15,18-Decahydro-2,11-diphenyl-11H-8,13a[2',3']-furanofuro[3',2':3,4]naphtho[1,2-b:7,8-b']dipyran-4,6,13,17(5H,12H)-tetrone		 95.65
C00014741 Chalcocaryanone C 95.65
C00014742 Chalcocaryanone D 95.65
C00014740 Chalcocaryanone B 94.57
C00014739 Chalcocaryanone A 90.22
C00013136 Pringlein 86.96
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 86.96
C00046246 Orbiculin A 86.96
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		 84.78
C00031269 Salasol B 84.78
C00032107 Paeonin A
(+)-Paeonin A		 84.78
C00032759 Benzoyloxypaeoniflorin
Oxypaeoniflorin 6'-benzoate		 84.78
C00035056 Barbatin B
(-)-Barbatin B		 84.78
C00044106 Benzoylpaeoniflorin 84.78
C00039807 Mutangin 84.38
C00044977 Orthosiphol T
(-)-Orthosiphol T		 84.38
C00048039 Paeonidanin C
(-)-Paeonidanin C		 83.87
C00010484 Arborside A 83.70
C00013133 Cathidine D 83.70
C00013134 (-)-Triptofordin C 2
Triptofordin C 2		 83.70
C00013135 (-)-Triptofordin C 1
Triptofordin C 1		 83.70
C00017062 RF 1023B
Trapoxin B		 83.70
C00044981 Orthosiphol X
(-)-Orthosiphol X		 83.33
C00047715 Alternaramide 82.98
C00035955 6alpha-Acetoxy-9beta-benzoyloxy-1beta-cinnamoyloxy-8beta-(2-methylbutanoyloxy)-beta-dihydroagarofuran 82.65
C00003440 Ingenol 3,20-dibenzoate
Ingenol-3,20-dibenzoate
(+)-Ingenol 3,20-dibenzoate		 82.61
C00014342 4'-O-Methylcarthamidin 7-(2-p-coumaroylglucoside)
5,6,7-Trihydroxy-4'-methoxyflavanone 7-(2-p-coumaroylglucoside)		 82.61
C00035055 Barbatin A
(-)-Barbatin A		 82.61
C00044276 Paeonidaninol B 82.61
C00050042 Cryptophycin 176 82.61
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		 82.29
C00032099 Orthosiphol K
(-)-Orthosiphol K		 82.29
C00043421 Cryptophycin 38 82.11
C00045038 Reissantin A 81.91
C00050055 Delavayin A 81.91
C00038693 Campneoside II
(-)-Campneoside II		 81.72
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		 81.52
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 81.52
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		 81.52
C00014410 Taxifolin 3-(3-cinnamoylrhamnoside) 81.52
C00032195 Spumigin C 81.52
C00043786 Oboflavanone A
(-)-Oboflavanone A		 81.52
C00046248 Orbiculin E
(+)-Orbiculin E		 81.52
C00046393 Scuterulein B
(-)-Scuterulein B		 81.52
C00050229 Scupontin G
(-)-Scupontin G		 81.52
C00035149 Picroroside C
(-)-Picroroside C		 81.44
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		 81.25
C00033733 Cryptophycin A
(-)-Cryptophycin A		 81.05
C00036871 Campneoside I 81.05
C00043419 Cryptophycin 326
(+)-Cryptophycin 326		 81.05
C00043420 Cryptophycin 327
(+)-Cryptophycin 327		 81.05
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