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


and

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




INPUT WORD = C00029582 , 50% or more
[ Metabolite Name : 6-O-Nicotinoyl-7-O-acetylscutebarbatine G ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029592 7-O-Nicotinoylscutebarbatine H 91.58
C00035055 Barbatin A
(-)-Barbatin A		 87.37
C00028975 Scutebarbatine A 86.32
C00031329 Scutebarbatine F
(-)-Scutebarbatine F		 86.32
C00044977 Orthosiphol T
(-)-Orthosiphol T		 84.38
C00044981 Orthosiphol X
(-)-Orthosiphol X		 84.38
C00031335 Scutebarbatine L
(-)-Scutebarbatine L		 84.21
C00035056 Barbatin B
(-)-Barbatin B		 84.21
C00049352 7,2'-Bisdeacetoxyaustropicatine
(+)-7,2'-Bisdeacetoxyaustropicatine		 84.21
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 83.16
C00045038 Reissantin A 83.16
C00046393 Scuterulein B
(-)-Scuterulein B		 83.16
C00049418 CID is old! 83.16
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		 82.29
C00032099 Orthosiphol K
(-)-Orthosiphol K		 82.29
C00039807 Mutangin 82.29
C00013136 Pringlein 82.11
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		 82.11
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		 82.11
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		 82.11
C00047648 1-Deacetylkhivorin 82.11
C00030237 Euphoscopin C 81.44
C00038442 Amotsangin E
(+)-Amotsangin E		 81.44
C00025030 Vakognavine 81.25
C00032101 Orthosiphol N
(-)-Orthosiphol N		 81.25
C00001647 Indaconitine 81.05
C00013133 Cathidine D 81.05
C00016528 (+)-Pyripyropene J
Pyripyropene J		 81.05
C00024040 Scuterivulactone C2 3-O-acetate 81.05
C00024101 Swietemahonin F 81.05
C00028289 Gagaminin
Gagaminine		 81.05
C00031269 Salasol B 81.05
C00031326 Scutebarbatine C
(-)-Scutebarbatine C		 81.05
C00043437 Cyclotaxinine NN-2
(+)-Cyclotaxinine NN-2		 81.05
C00041147 Taxayuntin A 80.81
C00035955 6alpha-Acetoxy-9beta-benzoyloxy-1beta-cinnamoyloxy-8beta-(2-methylbutanoyloxy)-beta-dihydroagarofuran 80.61
C00024850 Cardiopinine
(-)-Cardiopinine		 80.41
C00041119 Scutalpin L 80.41
C00041165 Taxine II 80.41
C00041166 Taxinine E 80.41
C00047422 Cineracipadesin E
(-)-Cineracipadesin E		 80.21
C00003375 Thapsigargin 80.00
C00013134 (-)-Triptofordin C 2
Triptofordin C 2		 80.00
C00013135 (-)-Triptofordin C 1
Triptofordin C 1		 80.00
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 80.00
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		 80.00
C00016860 FO 1289D
Pyripyropene D		 80.00
C00031328 Scutebarbatine E
(-)-Scutebarbatine E		 80.00
C00032533 Xylogranatin B 80.00
C00040715 Xylocarpin G 80.00
C00041188 Taxuspine C 80.00
C00041198 Taxuspine Q
(-)-Taxuspine Q		 80.00
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