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


and

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




INPUT WORD = C00014744 , 50% or more
[ Metabolite Name : Neocalycopterone methyl ether , (2R,7aR,11R,13S,14aR)-2,3,12,13-Tetrahydro-6,7,7a,8,9,13-hexamethoxy-2,11-diphenyl-11H-furo[2,3-f:4,5-i']bis[1]benzopyran-5(7aH)-one ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013563 Calycopterone
(2R,7aS,11R,13S,14aR)-rel-(-)-2,3,12,13-Tetrahydro-8-hydroxy-6,7,7a,9,13-pentamethoxy-2,11-diphenyl-11H-furo[2,3-f:4,5-i']bis[1]benzopyran-5(7aH)-one		 97.96
C00013565 Isocalycopterone
(2R,7aS,11R,13S,14aR)-rel-(-)-2,3,12,13-Tetrahydro-9-hydroxy-6,7,7a,8,13-pentamethoxy-2,11-diphenyl-11H-furo[2,3-f:4,5-i']bis[1]benzopyran-5(7aH)-one		 96.94
C00013560 4-Demethylcalycopterone
4-Hydroxycalycopterone		 95.92
C00014743 Neocalycopterone
(2R,7aR,11R,13S,14aR)-2,3,12,13-Tetrahydro-13-hydroxy-6,7,7a,8,9-pentamethoxy-2,11-diphenyl-11H-furo[2,3-f:4,5-i']bis[1]benzopyran-5(7aH)-one		 95.92
C00014747 6''-Demethoxyneocalycopterone 93.88
C00014749 Calyflorenone C
(2S,4R,6S,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-4,8-dihydroxy-6,6a,12,13,13b-pentamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one		 93.88
C00014751 6-epi-Calyflorenone C
(2S,4R,6R,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-4,8-dihydroxy-6,6a,12,13,13b-pentamethoxy-2,10-diphenyl-, 5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one		 92.86
C00014746 Calyflorenone B
(2S,4R,6S,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-8-hydroxy-4,6,6a,12,13,13b-hexamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one		 92.00
C00014750 6-epi-Calyflorenone B
(2S,4R,6R,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-8-hydroxy-4,6,6a,12,13,13b-hexamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one		 91.00
C00014745 Calyflorenone A
(2S,4R,6S,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-octahydro-4,6,6a,8,12,13,13b-Heptamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one		 90.20
C00014748 Calyflorenone D
(2S,4R,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-4,8-dihydroxy-6a,12,13,13b-tetramethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one		 87.76
C00047751 Beilschmieflavonoid B
(+)-Beilschmieflavonoid B		 86.73
C00008798 Dependensin 84.69
C00047588 Tiegusanin D 83.17
C00014680 3-Hydroxy-4',5',7-trimethoxyflavone-(6->8'')-3'-hydroxy-3''',4''',5'',7-tetramethoxyflavone 82.86
C00025614 (-)-Limacine 2'-alpha-N-oxide 82.65
C00006524 Nallaflavanone 82.52
C00001866 Hernandezine 82.35
C00008901 Phylloflavanine 82.18
C00001923 Thalsimine 82.00
C00000668 Cannabisin E 81.63
C00001895 Obaberine 81.63
C00001919 (+)-Tetrandrine
Tetrandrine		 81.63
C00001922 Thalmine 81.63
C00006456 Agathisflavone tetramethyl ether 81.63
C00006464 Cupressuflavone tetramethyl ether 81.63
C00006502 Olivieriflavone 81.63
C00014693 Stephaflavone A
5,5'-Dihydroxy-7,7'-dimethoxy-2,2'-bis(4-methoxyphenyl)-[3,6'-bi-4H-1-benzopyran]-4,4'-dione		 81.63
C00025595 (-)-2-Norlimacine
(-)-2-Demethyllimacine
2-Norlimacine		 81.63
C00025624 (-)-Repandine
Repandine
N-Methyldemerarine
Repandin		 81.63
C00025642 (+)-2-Northalrugosine
Dihydrotiliafunimine		 81.63
C00025739 CID is old! 81.63
C00025741 2'-Nortetrandrine
Cycleanorin
Cycleanorine		 81.63
C00025855 Dihydrowarifteine 81.63
C00025874 Fenfangjine B 81.63
C00026082 Warifteine 81.63
C00027728 2'-Norisotetrandrine 81.63
C00047750 Beilschmieflavonoid A
(+)-Beilschmieflavonoid A		 81.63
C00006597 Bosistoabiflavanone dimer 81.19
C00007900 Okanin 4'-(3'',4''-diacetyl-6''-p-coumarylglucoside) 81.19
C00005870 Kaempferol 3-(2'',3''-diacetyl-4''-p-coumarylrhamnoside 81.00
C00014682 Anacarduflavanone 81.00
C00025742 2'-N-Oxyisotetrandrine 81.00
C00001863 Gyrocarpine 80.61
C00006455 7,7'',4'''-Tri-O-methylagathisflavone 80.61
C00006503 Dioonflavone 80.61
C00006599 Trianguletin 80.61
C00013655 Skullcapflavone I 2'-(4''-E-Cinnamoylglucoside)
5-Hydroxy-7,8-dimethoxy-2-[2-[[4-O-[(2E)-1-oxo-3-phenyl-2-propenyl]-beta-D-glucopyranosyl]oxy]phenyl]-4H-1-benzopyran-4-one		 80.61
C00014706 Ruixianglangdusu B
(2R,2'R,3S,3'S)-rel-(+)-2,2',3,3'-Tetrahydro-5,5',7-trihydroxy-7'-methoxy-2,2'-bis(4-methoxyphenyl)-[3,3'-bi-4H-1-benzopyran]-4,4'-dione		 80.61
C00025278 CID is old! 80.61
C00025321 (-)-Limacine 2'-beta-N-oxide
Limacine 2'-beta-N-oxide		 80.61
C00025601 (-)-Caryolivine
Caryolivine		 80.61
C00025677 (+)-Norpenduline
2-Demethylpenduline		 80.61
C00028135 Dehatrine 80.61
C00028769 O-Methylrepandine 80.61
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