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


and

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




INPUT WORD = C00036362 , 50% or more
[ Metabolite Name : 1,1,5-Trimethyl-2-formyl-4-methoxy-[2,5]-cyclohexadiene ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010981 Ferulol 92.31
C00010987 Filifolide A 88.46
C00036363 1,1,5-Trimethyl-2-formyl-6-methoxy-[2,4]-cyclohexadiene 88.46
C00043415 Crocusatin L
(+)-Crocusatin L		 88.46
C00003055 Piquerol A 84.62
C00010369 Santolinic acid methyl ester 84.62
C00010820 (1alpha,4alpha,7S*)-5-methylethyl)-2,3-dioxabicyclo[2.2.2]oct-5-ene 84.62
C00010822 (1alpha,4alpha,7R*)-5-methyl-7-(1-methylethyl)-2,3-dioxabicyclo[2.2.2]oct-5-ene 84.62
C00010915 (3S,4S,6R)-p-Menth-1-ene-3,6-diol 84.62
C00022661 4-Hydroperoxi-4,5-dihydro-chrysanthem-5-en-ol 84.62
C00032862 Crocusatin D
(-)-Crocusatin D		 84.62
C00037654 Piquerol B 84.62
C00043190 3-Formyl-6-hydroxy-2,4,4-trimethyl-2,5-cyclohexadien-1-one
4-Hydroxy-2,6,6-trimethyl-3-oxocyclohexa-1,4-diene-1-carboxaldehyde		 84.62
C00043412 Crocusatin I 84.62
C00043414 Crocusatin K
(+)-Crocusatin K		 84.62
C00037964 Tschimganical A
(+)-Tschimganical A		 82.76
C00035538 beta-Isocyclolavandulyl acetate 82.14
C00045805 Crocusatin G
(+)-Crocusatin G		 82.14
C00010426 (2R,4R,6S)-6-Bromo-1,4-epoxy-3(8)-ochtoden-2-ol
(3alpha,6beta,7aalpha)-(-)-6-bromo-2,3,5,6,7,7a-hexahydro-5,5-dimethyl-3-benzofuranol		 81.48
C00010427 (2S,4R,6S)-6-Bromo-1,4-epoxy-3(8)-ochtoden-2-ol
(3alpha,6alpha,7abeta)-(-)-6-bromo-2,3,5,6,7,7a-hexahydro-5,5-dimethyl-3-benzofuranol		 81.48
C00000146 (+)-Bottrospicatol 80.77
C00000158 2Z-Dehydromatricaria ester 80.77
C00010315 Elsholtzidiol 80.77
C00010316 Elsholtzione 80.77
C00010358 4-Ethenyl-3-hydroxy-2-hydroxymethyl-2,5,5-trimethyltetrahydrofuran 80.77
C00010429 2-Chloro-1hydroxy-3(8),5-ochtodien-4-one 80.77
C00010439 (1E,4R,6S)-1,6-Dibromo-1,3(8)-ochtodien-4-ol
[1alpha,2(E),5alpha]-(-)-5-bromo-2-(2-bromoethenyl)-4,4-dimethyl-2-cyclohexen-1-ol		 80.77
C00010440 (1E,4S,6S)-1,6-Dibromo-1,3(8)-ochtodien-4-ol
[1alpha,2(E),5beta]-(-)-5-bromo-2-(2-bromoethenyl)-4,4-dimethyl-2-cyclohexen-1-ol		 80.77
C00010817 1,2-Dihydroxy-p-menth-3-en-5-one 80.77
C00010849 (4S-trans)-4-Hydroxy-2-methyl-5-(1-methylethyl)-2-cyclohexen-1-one 80.77
C00010850 (4S-cis)-4-Hydroxy-2-methyl-5-(1-methylethyl)-2-cyclohexen-1-one 80.77
C00010852 (S)-6-Hydroxy-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-one 80.77
C00010895 (1R,2R,4R,5S)-(+)-p-Menthane-2,5-diol 80.77
C00010993 (+)-5-Hydroxy-4,6,6-trimethyl-1,3-cyclohexadiene-1-carboxaldehyde 80.77
C00011004 4,4-Dimethyl-2,5-cycloheptadienecarboxylic acid 80.77
C00011015 Angelicoidenol 80.77
C00011050 (+-)-Asarinol A 80.77
C00011495 Nordavanone 80.77
C00021846 Norecasantalol 80.77
C00021847 Norecasantalal
eka-Nortricyclosantalal		 80.77
C00021856 exo-Norbicycloekasantalal 80.77
C00022009 Sobrerol 80.77
C00029590 7-Methoxy-3,7-dimethyl-octanal 80.77
C00030482 Hexyl tiglate 80.77
C00032860 Crocusatin B
(+)-Crocusatin B		 80.77
C00033346 Sachalinol A 80.77
C00033347 Sachalinol B
(+)-Sachalinol B		 80.77
C00033348 Sachalinol C
(+)-Sachalinol C		 80.77
C00035472 2,2,6-Trimethyldecane 80.77
C00036900 Chrysanthemyl acetate 80.77
C00043413 Crocusatin J
(+)-Crocusatin J		 80.77
C00043623 Isotsaokoin 80.77
C00048140 Speciosin H
(-)-Speciosin H		 80.77
C00048141 Speciosin I
(+)-Speciosin I		 80.77
C00048142 Speciosin J
(+)-Speciosin J		 80.77
Page Top