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


and

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




INPUT WORD = C00040446 , 50% or more
[ Metabolite Name : Tasumatrol U ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00037893 Taxuyunnanine R 93.51
C00040854 9-Deacetyl-9-benzoyl-10-debenzoylbrevifoliol
(+)-9-Deacetyl-9-benzoyl-10-debenzoylbrevifoliol		 88.31
C00043117 Wallifoliol
(-)-Wallifoliol		 87.95
C00013184 Ejap 2
[3R-(3alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]- 5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5,6,10-triol 6,10-diacetate 5-benzoate		 87.01
C00013151 [3R-(3a,4b,5a,5aa,6a,9b,9aa,10R*)]-5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-Methano-1-benzoxepin-4,5,6,9,10-pentol 5-acetate 6-benzoate 86.84
C00013170 [3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-Octahydro-2,2,5a,9-tetramethyl-, 5,10-diacetate 6-benzoate H-3,9a-methano-1-benzoxepin-4,5,6,9,10-pentol 86.84
C00040450 Tasumatrol Y 86.75
C00046946 Taxuyunnanine K
(-)-Taxuyunnanine K		 86.75
C00046947 Taxuyunnanine L
(-)-Taxuyunnanine L		 86.75
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 86.08
C00011870 Lacinolide A 85.53
C00045042 Reissantin E 85.53
C00046949 Taxuyunnanine N
(-)-Taxuyunnanine N		 85.53
C00049220 Malayenolide B
(+)-Malayenolide B		 85.53
C00036417 15-Benzoyl-10-deacetyl-2-debenzoyl-10-dehydro-abeo-baccatin III 85.37
C00040183 Salasol A 84.81
C00040835 5-Cinnamoyl-10-acetyltaxicin II 84.81
C00013178 (+)-Triptofoldin B
TWHR 2
Triptofoldin B
Triptofordin B
[3R-(3alpha,5beta,5aalpha,6alpha,9beta,9aalpha,10R*)]-Octahydro-2,2,5a,9-tetramethyl-, 5,6-dibenzoate 2H-3,9a-methano-1-benzoxepin-5,6,9,10-tetrol		 84.21
C00013180 Mortonol A
[3S-(3alpha,5beta,5aalpha,6alpha,9beta,9aalpha)]-5,6-bis(Benzoyloxy)octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-10-one		 84.21
C00037892 Taxuyunnanine Q 84.21
C00035995 10-Deacetylbaccatin III 84.15
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 83.54
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 83.54
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		 83.54
C00035938 3-O-Deacetylorthosiphol I
(-)-3-O-Deacetylorthosiphol I		 83.54
C00038716 Celahin C 83.54
C00041205 Taxuspine Y
(-)-Taxuspine Y		 83.13
C00010797 Centapicrin 83.12
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		 83.12
C00031700 Cucurbitoside C
(-)-Cucurbitoside C		 83.12
C00033413 Taxumairol Y
(+)-Taxumairol Y		 83.12
C00045595 8-O-E-p-Methoxycinnamoylharpagide 83.12
C00040768 13-epi-10-Deacetylbaccatin III
(-)-13-epi-10-Deacetylbaccatin III		 82.93
C00041185 Taxuspinanane C
(+)-Taxuspinanane C		 82.93
C00042031 10-Deacetyl-10-oxobaccatin III 82.93
C00033410 Taxumairol J
(+)-Taxumairol J		 82.89
C00039336 Harpagoside B
(-)-Harpagoside B		 82.89
C00041196 Taxuspine O 82.89
C00046617 Anthoptilide D
(+)-Anthoptilide D		 82.89
C00048366 CID is old! 82.89
C00048472 Macarangioside E
(+)-Macarangioside E		 82.89
C00049499 O-Cinnamoyltaxicin I 82.89
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 82.72
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 82.72
C00024038 Scuterivulactone C1 82.50
C00024039 Scuterivulactone C2 82.50
C00024822 1-O-Acetylhypognavine
Hypognavine 1-acetate		 82.28
C00046030 Intrapetacin A
(-)-Intrapetacin A		 82.28
C00042057 19-Hydroxy-10-deacetylbaccatin III 82.14
C00013202 Mortonin D
(3alpha,4beta,6alpha,6abeta,7beta,10alpha,10aalpha)-10-Tetramethyl-6,7-bis(benzoyloxy)octahydro-10-hydroxy-3,4,6a 3H-3,10a-epoxy-1H-2-benzoxocin-1-one		 82.05
C00024037 Scuterivulactone B 82.05
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