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


and

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





INPUT WORD = C00013139 , 50% or more
[ Metabolite Name : Maytine ]
Number of matched data : 54

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013128 Maytoline 95.51
C00013166 [3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,7,10-triacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,10-tetrol 94.25
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
94.25
C00013147 [3R-(3alpha,4alpha,5alpha,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-Octahydro-5a-(hydroxymethyl)-2,2,9-trimethyl-, 4,6,7,10-tetraacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol 91.95
C00013153 [3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-4,5,6,9,10-pentol 4,5,10-triacetate 6-benzoate 91.95
C00013143 Ejap 12
[3R-(3alpha,4alpha,5alpha,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 5,7,10-triacetate 4-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol
90.80
C00013175 Ejap 3
2[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]- 5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-H-3,9a-methano-1-benzoxepin-4,5,6,10-tetrol 4,6,10-triacetate 5-benzoate
90.80
C00001968 Celapanine 89.66
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
87.78
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
87.36
C00046248 Orbiculin E
(+)-Orbiculin E
87.36
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
87.10
C00041368 Austronine 86.96
C00041177 Taxumairol F 86.52
C00044343 Taxayuntin H
(-)-Taxayuntin H
86.52
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
86.36
C00045158 16-Acetoxymilolide M
(+)-16-Acetoxymilolide M
86.36
C00046452 Taxumairol U
(-)-Taxumairol U
86.36
C00013131 Celangulin 86.32
C00013185 Ejap 7
[3R-(3alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]-6,10-bis(Acetyloxy)-5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid
86.21
C00030569 Junceol G 86.21
C00031077 Praelolide
(-)-Praelolide
86.21
C00039222 Frajunolide F
(-)-Frajunolide F
86.21
C00039225 Frajunolide I
(-)-Frajunolide I
86.21
C00039508 Juncin Z
(+)-Juncin Z
86.21
C00042050 13-Deacetoxybaccatin I 86.21
C00050094 Esulatin B
(-)-Esulatin B
86.21
C00013142 Ejap 5
[3R-(3alpha,4alpha,5alpha,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 5,6,7,10-tetraacetate 4-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol
86.02
C00049839 Stecholide K 85.87
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
85.71
C00040447 Tasumatrol V 85.71
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
85.56
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
85.42
C00041192 Taxuspine K 85.39
C00041203 Taxuspine V 85.39
C00039507 Juncin Y
(+)-Juncin Y
85.23
C00042338 Caseamembrin D
(+)-Caseamembrin D
85.23
C00044344 Taxayuntin J
(-)-Taxayuntin J
85.23
C00045347 Milolide J
(+)-Milolide J
85.23
C00012077 5-Acetoxy-2,4-dihydroxykleinifulgin 85.06
C00012283 [3aS-[3aR*,4R*(Z),5R*,6E,11R*,11aR*]]-11-(Acetyloxy)-4-[[2-[(acetyloxy)methyl]-1-oxo-2-butenyl]oxy]-2,3,3a,4,5,8,9,10,11,11a-decahydro-3,10-bis(methylene)-5-(2-methyl-1-oxopropoxy)-2-oxo-, methyl ester cyclodeca[b]furan-6-carboxylic acid 85.06
C00013165 [3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-Octahydro-5a-(hydroxymethyl)-2,2,9-trimethyl-, 6,7,10-triacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,10-tetrol 85.06
C00031329 Scutebarbatine F
(-)-Scutebarbatine F
85.06
C00031586 Ajugamacrin B 85.06
C00038716 Celahin C 85.06
C00040183 Salasol A 85.06
C00040977 Glabcensin N
(-)-Glabcensin N
85.06
C00040982 Glabcensin S
(-)-Glabcensin S
85.06
C00040983 Glabcensin T
(-)-Glabcensin T
85.06
C00042306 Briaranolide D
(+)-Briaranolide D
85.06
C00042308 Briaranolide F
(-)-Briaranolide F
85.06
C00045313 Erythrolide O
(+)-Erythrolide O
85.06
C00046454 Taxumairol W
(-)-Taxumairol W
85.06
C00049868 CID is old! 85.06
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