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


and

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




INPUT WORD = C00013142 , 50% or more
[ Metabolite Name : 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 ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
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		 97.85
C00013131 Celangulin 95.79
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		 93.55
C00013130 Ejap 6 92.08
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 91.40
C00040856 9-Dihydro-13-acetylbaccatin III 90.43
C00013134 (-)-Triptofordin C 2
Triptofordin C 2		 90.32
C00013135 (-)-Triptofordin C 1
Triptofordin C 1		 90.32
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 90.32
C00041184 Taxuspinanane B
(+)-Taxuspinanane B		 90.32
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		 89.58
C00039807 Mutangin 89.58
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		 89.42
C00013128 Maytoline 89.25
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 89.25
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		 89.25
C00041152 Taxchinin A 89.25
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		 88.78
C00041155 Taxchinin D 88.66
C00041148 Taxayuntin E 88.30
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		 88.17
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 88.17
C00040783 1-Dehydroxybaccatin IV
(+)-1-Dehydroxybaccatin IV		 88.17
C00041193 Taxuspine L 88.17
C00046393 Scuterulein B
(-)-Scuterulein B		 88.17
C00038159 Taxayuntin
13-Decinnamoyl-taxchinin B		 88.00
C00043058 Taxiflorine
(-)-Taxiflorin		 87.76
C00041198 Taxuspine Q
(-)-Taxuspine Q		 87.37
C00041149 Taxayuntin F 87.23
C00043057 Tasumatrol G
(-)-Tasumatrol G		 87.23
C00043437 Cyclotaxinine NN-2
(+)-Cyclotaxinine NN-2		 87.23
C00045038 Reissantin A 87.23
C00045385 Prunose II
(+)-Prunose II		 87.23
C00013133 Cathidine D 87.10
C00013136 Pringlein 87.10
C00031269 Salasol B 87.10
C00040776 19-Hydroxybaccatin III 87.10
C00040890 Baccatin I 87.10
C00041368 Austronine 87.10
C00041519 Florxenilide B
(+)-Florxenilide B		 87.10
C00044343 Taxayuntin H
(-)-Taxayuntin H		 87.10
C00044344 Taxayuntin J
(-)-Taxayuntin J		 87.10
C00049343 13-O-Acetyl-brevifoliol
13-alpha-O-Acetylbrevifoliol		 87.10
C00049403 Taxezopidine G
(+)-Taxezopidine G		 87.10
C00041166 Taxinine E 86.60
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		 86.46
C00033411 Taxumairol L
(+)-Taxumairol L		 86.17
C00013139 Maytine 86.02
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		 86.02
C00024817 15-Deacetylvakognavine 86.02
C00031807 Gemmacolide A
(-)-Gemmacolide A		 86.02
C00032599 13-O-Deacetyltaxumairol Z
(-)-13-O-Deacetyltaxumairol Z		 86.02
C00033277 Orthosiphol J
(-)-Orthosiphol J		 86.02
C00035069 Cheiradone 86.02
C00036218 Taxezopidine H 86.02
C00040809 2-Deacetoxytaxinine B 86.02
C00041150 Taxchin A
(+)-Taxchin A		 86.02
C00041188 Taxuspine C 86.02
C00041194 Taxuspine M 86.02
C00041913 Taxchinin N
(+)-Taxchinin N		 86.02
C00042304 Briaranolide B
(+)-Briaranolide B		 86.02
C00043056 Tasumatrol F
(+)-Tasumatrol F		 86.02
C00046246 Orbiculin A 86.02
C00046248 Orbiculin E
(+)-Orbiculin E		 86.02
C00049375 Excavatolide I
(+)-Excavatolide I		 86.02
C00049410 10-Deacetyltaxinine B
(+)-10-Deacetyltaxinine B		 86.02
C00049535 CID is old! 86.02
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