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


and

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




INPUT WORD = C00013145 , 50% or more
[ Metabolite Name : 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 ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013131 Celangulin 97.89
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		 97.85
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 93.55
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		 91.40
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		 91.40
C00039807 Mutangin 90.63
C00013128 Maytoline 90.32
C00013134 (-)-Triptofordin C 2
Triptofordin C 2		 90.32
C00013135 (-)-Triptofordin C 1
Triptofordin C 1		 90.32
C00013136 Pringlein 90.32
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 90.32
C00013130 Ejap 6 90.10
C00043055 Tasumatrol E
(+)-Tasumatrol E		 89.47
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
C00041149 Taxayuntin F 89.36
C00045038 Reissantin A 89.36
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 89.25
C00031269 Salasol B 89.25
C00041184 Taxuspinanane B
(+)-Taxuspinanane B		 89.25
C00043057 Tasumatrol G
(-)-Tasumatrol G		 88.30
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 88.17
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		 88.17
C00033277 Orthosiphol J
(-)-Orthosiphol J		 88.17
C00035123 Karajinone B 88.17
C00040783 1-Dehydroxybaccatin IV
(+)-1-Dehydroxybaccatin IV		 88.17
C00041152 Taxchinin A 88.17
C00041368 Austronine 88.17
C00044978 Orthosiphol U
(-)-Orthosiphol U		 88.17
C00046393 Scuterulein B
(-)-Scuterulein B		 88.17
C00038159 Taxayunnansin A
Taxayuntin
13-Decinnamoyl-taxchinin B		 88.00
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		 87.76
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		 87.50
C00041171 Taxuchin A 87.37
C00046249 Orbiculin F
(+)-Orbiculin F		 87.37
C00043437 Cyclotaxinine NN-2
(+)-Cyclotaxinine NN-2		 87.23
C00013139 Maytine 87.10
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		 87.10
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 87.10
C00040890 Baccatin I 87.10
C00040892 Baccatin V 87.10
C00041187 Taxuspine B 87.10
C00041188 Taxuspine C 87.10
C00043056 Tasumatrol F
(+)-Tasumatrol F		 87.10
C00044343 Taxayuntin H
(-)-Taxayuntin H		 87.10
C00045826 Dantaxusin A
(+)-Dantaxusin A		 87.10
C00046246 Orbiculin A 87.10
C00046248 Orbiculin E
(+)-Orbiculin E		 87.10
C00049410 10-Deacetyltaxinine B
(+)-10-Deacetyltaxinine B		 87.10
C00049531 Taxchinin M
(-)-Taxchinin M		 87.00
C00035122 Karajinone A 86.87
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