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


and

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




INPUT WORD = C00045070 , 50% or more
[ Metabolite Name : Secoorthosiphol B ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00044974 Orthosiphol D 93.98
C00031548 2-O-Deacetylorthosiphol J
(-)-2-O-Deacetylorthosiphol J		 92.94
C00032100 Orthosiphol M
(-)-Orthosiphol M		 92.94
C00044979 Orthosiphol V
(-)-Orthosiphol V		 92.94
C00044980 Orthosiphol W
(-)-Orthosiphol W		 92.94
C00044973 Orthosiphol C
(-)-Orthosiphol C		 92.68
C00033275 Orthosiphol G
(-)-Orthosiphol G		 91.76
C00033276 Orthosiphol I
(-)-Orthosiphol I		 91.76
C00035938 3-O-Deacetylorthosiphol I
(-)-3-O-Deacetylorthosiphol I		 91.46
C00036417 15-Benzoyl-10-deacetyl-2-debenzoyl-10-dehydro-abeo-baccatin III 89.02
C00046212 Norstaminone A 89.02
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		 88.24
C00043117 Wallifoliol
(-)-Wallifoliol		 87.95
C00046947 Taxuyunnanine L
(-)-Taxuyunnanine L		 87.95
C00040769 14beta-Hydroxy-10-deacetylbaccatin III 86.90
C00033277 Orthosiphol J
(-)-Orthosiphol J		 86.81
C00044978 Orthosiphol U
(-)-Orthosiphol U		 86.81
C00040450 Tasumatrol Y 86.75
C00048946 CID is old! 86.75
C00013152 [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 5,10-diacetate 6-benzoate 86.59
C00013155 [3S-(3alpha,5alpha,5aalpha,6alpha,9beta,9aalpha,10S*)]-5,10-bis(Acetyloxy)-5a-[(acetyloxy)methyl]-6-(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-4H-3,9a-methano-1-benzoxepin-4-one 86.59
C00013173 [3R-(3alpha,5beta,5aalpha,6alpha,9beta,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5,6,9,10-tetrol 5,10-diacetate 6-benzoate 86.59
C00024038 Scuterivulactone C1 86.59
C00024039 Scuterivulactone C2 86.59
C00035995 10-Deacetylbaccatin III 86.59
C00040183 Salasol A 86.59
C00040768 13-epi-10-Deacetylbaccatin III
(-)-13-epi-10-Deacetylbaccatin III		 86.59
C00041185 Taxuspinanane C
(+)-Taxuspinanane C		 86.59
C00042031 10-Deacetyl-10-oxobaccatin III 86.59
C00042032 10-Deacetyl-13-oxobaccatin III
(-)-10-Deacetyl-13-oxobaccatin III		 86.59
C00045504 10-Deacetyl-10-oxo-baccatin V 86.59
C00025019 Tadzhaconine
Anthoroidine
Tadjaconine
Tadzhakonine		 85.88
C00040903 Brevifoliol 85.54
C00046031 Intrapetacin B
(-)-Intrapetacin B		 85.54
C00046946 Taxuyunnanine K
(-)-Taxuyunnanine K		 85.54
C00047689 7-Deacetylkhivorin 85.54
C00050081 E-6-O-p-coumaroyl scandoside methyl ester 10-O-methyl methyl ether 85.54
C00011353 19,20-Epoxycytochalasin Q 85.37
C00013171 [3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-Octahydro-2,2,5a,9-tetramethyl-, 4,5,10-triacetate 6-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,9,10-pentol 85.37
C00013177 Ejap 10
[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,10-diacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,10-tetrol		 85.37
C00013183 Deacetylcelapanigine
Celapagine
6-(Acetyloxy)-10-(benzoyloxy)octahydro-4-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid		 85.37
C00021416 Lapidolinin 85.37
C00024814 15-Acetylsongoramine 85.37
C00027702 19,20-Epoxycytochalasin D 85.37
C00030234 Euphornin C 85.37
C00030235 Euphoscopin A 85.37
C00038716 Celahin C 85.37
C00040836 5-Cinnamoyl-9-acetyltaxicin I 85.37
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		 85.06
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 85.06
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