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


and

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




INPUT WORD = C00033161 , 50% or more
[ Metabolite Name : Marrubiglobosin , (+)-Marrubiglobosin ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00033162 Marrubinone B
(+)-Marrubinone B:Polyodonin		 96.30
C00003476 (13R)-Premarrubiin 94.34
C00023348 Preperegrinin 92.59
C00048251 13S-Preperegrinine
(+)-13S-Preperegrinine		 92.59
C00023347 (13S)-Premarrubiin 92.45
C00031972 Leopersin C 92.45
C00035728 Preleoheterin 92.45
C00041625 Leucasperol A 92.45
C00041626 Leucasperol B 92.45
C00050317 15-epi-Leopersin J 92.45
C00050377 Leopersin J 92.45
C00050378 Leopersin K
(-)-Leopersin K		 92.45
C00042055 15-epi-Leopersin O 90.91
C00042056 15-epi-Leopersin Q 90.91
C00042690 Leopersin O 90.91
C00042691 Leopersin Q 90.91
C00050375 Leopersin H
(+)-Leopersin H		 90.91
C00035207 15-epi-Cyllenine A 90.74
C00035287 Cyllenine A 90.74
C00041247 15-epi-Cyllenin A 90.74
C00041472 Cyllenin A 90.74
C00022266 Peregrinin 90.57
C00022392 Leonotin 90.57
C00022394 Ballotenol 90.57
C00031507 15-Epileoheteronone B 90.57
C00031967 Leoheteronone B 90.57
C00023349 Rotundifuran 89.09
C00043159 15-epi-Sibiricinone D 89.09
C00043160 15-epi-Sibiricinone E 89.09
C00043920 Sibiricinone D 89.09
C00043921 Sibiricinone E 89.09
C00022217 Leonotinin 88.89
C00043601 Hypopurin B
(+)-Hypopurin B		 88.89
C00043917 Sibiricinone A
(+)-Sibiricinone A		 88.89
C00045995 Haterumaimide F
(+)-Haterumaimide F		 88.89
C00045996 Haterumaimide G
(+)-Haterumaimide G		 88.89
C00003257 Eremantholide A 88.68
C00003452 Marrubiin 88.68
C00022294 Marrubenol 88.68
C00022354 Epijabugotriol 88.68
C00022391 Ballotinone
7-Oxomarrubiin		 88.68
C00023366 Dihydroclutiolide 88.68
C00023367 Isodihydroclutiolide 88.68
C00023397 Haplomitrenolide B 88.68
C00031508 15-Epileoheteronone D 88.68
C00031969 Leoheteronone D 88.68
C00035425 Velutine C 88.68
C00041663 Marrulibanoside 88.68
C00043600 Hypopurin A
(+)-Hypopurin A		 88.68
C00047256 Isoscoparin H
(+)-Isoscoparin H		 88.68
C00048283 3alpha-Hydroxymarrubiin
(+)-3alpha-Hydroxymarrubiin		 88.68
C00050379 Leopersin L
(-)-Leopersin L		 88.68
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