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


and

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




INPUT WORD = C00038004 , 50% or more
[ Metabolite Name : Vitetrifolin C , (+)-Vitetrifolin C ]
Number of matched data : 75

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00022317 18-Oxoaustrochaparol acetate 96.30
C00038003 Vitetrifolin B
(-)-Vitetrifolin B		 96.30
C00022315 5-Episophocarpine 94.44
C00022329 Austrochaparol acetate 94.44
C00022259 Calyone 92.86
C00022260 Galeopsin 92.86
C00045710 Cacofuran A
(-)-Cacofuran A		 92.73
C00046326 Potamogetonol
(+)-Potamogetonol		 92.59
C00022395 Galeuterone 91.38
C00022251 Vitexilactone 91.07
C00023349 Rotundifuran 90.91
C00048160 Sucutinirane E 90.91
C00022274 Calyenone 90.74
C00022412 Lagerstronolide 90.74
C00023390 12,15-Epoxy-8(17),12,14-labdatrien-16-ol acetate 90.74
C00022390 7-Acetoxymarrubin 89.83
C00022385 Leosibirin 89.66
C00042059 19-Hydroxygaleopsin 89.66
C00022175 1-Bromo-8-ketoambliol A 89.09
C00003452 Marrubiin 88.89
C00022223 3beta-Hydroxyisoagatholal acetate 88.89
C00022253 19-Acetylvillenolone 88.89
C00022266 Peregrinin 88.89
C00022336 16-Acetoxycarterochaetol 88.89
C00022383 15,16-Epoxy-20-oxo-8(17),13(16),14-labdatrien-19-oic acid methyl ester 88.89
C00022391 Ballotinone
7-Oxomarrubiin		 88.89
C00022534 3alpha-Hydroxy-5beta,10beta-epoxychiliolide 88.89
C00022746 19-Acetoxyvillenatriol
19-Acetoxy-8(17),13E-labdadiene-7alpha,15-diol		 88.89
C00023366 Dihydroclutiolide 88.89
C00029399 15-Ethoxy-hedyforrestin D 88.89
C00031965 Leoheteronin E
(-)-Leoheteronin E
Isoleopersin G		 88.89
C00022393 Dubiin 88.14
C00022270 ent-3beta-Acetoxy-15,16-epoxy-8(17),13(16),14-labdatrien-18-oic acid 87.93
C00022651 Acetoxygutierrezianolic acid methyl ester 87.93
C00023346 Precalyone 87.72
C00035293 Deoxyfruticolone 87.72
C00035715 Otostegin A
(-)-Otostegin A		 87.72
C00022250 Evillosin 87.50
C00022491 3-Oxo-18-acetoxy-8(17),13Z-labdadien-15-oic acid 87.27
C00031643 Caesaldekarin A
(+)-Caesaldekarin A		 87.27
C00041848 Sarcrassin A
(-)-Sarcrassin A		 87.27
C00047230 Eubol 87.27
C00048157 Sucutinirane B
(-)-Sucutinirane B		 87.27
C00048161 Sucutinirane F 87.27
C00022048 Furodivaricatic acid 87.04
C00022217 Leonotinin 87.04
C00022268 Hispanolone 87.04
C00022343 Hamachilobene E 87.04
C00022392 Leonotin 87.04
C00022394 Ballotenol 87.04
C00022488 2beta-Acetoxy-8(17),13E-labdadien-15-oic acid 87.04
C00022489 2beta-Acetoxy-8(17),13Z-labdadien-15-oic acid 87.04
C00022514 3beta-Acetoxy-8(17),13E-labdadien-15-oic acid 87.04
C00022518 ent-8(17),13E-Labdadien-7alpha,15-diol acetate 87.04
C00022533 3alpha-Hydroxy-5,6-dehydrochiliolide 87.04
C00022536 Isochiliolide lactone 87.04
C00022543 6beta-Hydroxy-incana-pteroniolide 87.04
C00022553 8(17)-Dehydroisochiliolide lactone 87.04
C00022771 Pinusolide 87.04
C00023350 Sciadin 87.04
C00023360 3beta-Acetoxy-8beta,15-dihydroxy-ent-labda-13E-ene 87.04
C00023365 Clutiolide 87.04
C00023367 Isodihydroclutiolide 87.04
C00031513 15-Methoxypinusolidic acid
(+)-15-Methoxypinusolidic acid		 87.04
C00031960 Leoheterin
(+)-Leoheterin		 87.04
C00035425 Velutine C 87.04
C00036529 3-Acetoxycopalic acid 87.04
C00042324 Caesalmin G
(+)-Caesalmin G		 87.04
C00043384 Chagresnol
(-)-Chagresnol		 87.04
C00043601 Hypopurin B
(+)-Hypopurin B		 87.04
C00046593 Labda-8(17),11,13-trien-15(16)-olide
(+)-Labda-8(17),11,13-trien-15(16)-olide		 87.04
C00046796 CID is old! 87.04
C00048283 3alpha-Hydroxymarrubiin
(+)-3alpha-Hydroxymarrubiin		 87.04
C00049324 Velamolone acetate 87.04
C00050374 Leopersin G
(+)-Leopersin G		 87.04
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