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


and

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





INPUT WORD = C00032859 , 50% or more
[ Metabolite Name : Crocusatin A , S-Phorenol ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035002 2,6,6-Trimethyl-2-cyclohexene-1,4-dione
4-Ketoisophorone
95.45
C00010925 (3S,4S)-(-)-p-Menth-1-en-3-ol
trans-(-)-Piperitol
90.91
C00010926 (3R,4R)-Piperitol
(+)-trans-Piperitol
90.91
C00010942 (+-)-p-Menth-6-en-3-one 90.91
C00032863 beta-Isophorone
Crocusatin E
beta-Phorone
90.91
C00035001 2,6,6-Trimethyl 1,4-cyclohexanedione
2,6,6-Trimethyl-1,4-cyclohexanedione
90.91
C00042278 beta-Cyclocitral 90.91
C00043204 4-Hydroxy-3,5,5-trimethylcyclohex-2-enone 90.91
C00010442 (5R,6R)-1,3(8)-Ochtodiene-5,6-diol 87.50
C00031537 2,6,6-Trimethyl-4-hydroxy-1-cyclohexene-1-carboxaldehyde 87.50
C00045543 2-Hydroxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione 87.50
C00000863 R-(+)-trans-Verbenol 86.96
C00029977 cis-Verbenol 86.96
C00038525 Aspinotriol A
(-)-Aspinotriol A
86.96
C00000815 (-)-trans-Isopiperitenol 86.36
C00010802 4-Isopropenyl-1-cyclopenten-1-yl methyl ketone
1-Acetyl-4-isopropenylcyclopentene
86.36
C00010804 alpha-Campholenol
Trimenol
Campholenic alcohol
86.36
C00010805 alpha-Campholenic aldehyde
Campholenic aldehyde
86.36
C00010930 delta-Terpineol
p-Menth-1(7)-en-8-ol
86.36
C00010931 (R)-(+)-alpha-Terpineol
(R)-(+)-p-Menth-1-en-8-ol
86.36
C00010998 beta-Cyclolavandulal
2,4,4-Trimethyl-1-cyclohexene-1-carboxyaldehyde
86.36
C00030540 alpha-Isophorone
Isophorone
86.36
C00011050 (+-)-Asarinol A 84.00
C00010316 Elsholtzione 83.33
C00010993 (+)-5-Hydroxy-4,6,6-trimethyl-1,3-cyclohexadiene-1-carboxaldehyde 83.33
C00002054 Mearsine 82.61
C00003067 (R)-(+)-Verbenone
Verbenone
82.61
C00010290 2,6-Dimethyl-1,7-octadiene-3,6-diol 82.61
C00010323 6-Hydroxy-2,6-dimethyl-7-octen-4-one
(+-)-Tagetonol
82.61
C00011049 Car-3-en-5-one 82.61
C00038526 Aspinotriol B
(+)-Aspinotriol B
82.61
C00000809 (-)-Isopiperitenone 81.82
C00000810 (-)-Menthol 81.82
C00000811 (-)-Menthone 81.82
C00000820 (+)-cis-Isopulegone
(2R-cis)-5-methyl-2-(1-methylethenyl)-cyclohexanone
81.82
C00000822 (+)-Isomenthol 81.82
C00000824 (+)-Neoisomenthol 81.82
C00000825 (+)-Neomenthol 81.82
C00000855 beta-Nerol
Nerol
cis-Geraniol
(Z)-Geraniol
81.82
C00003054 Piperitone
p-Menth-1-en-3-one
(+)-Piperitone
81.82
C00010312 (+)-2,6-Dimethyloct-7-en-4-one
(S)-3,7-Dimethyl-1-octen-5-one
81.82
C00010348 Tetrahydro-2,2-dimethyl-5-(1-methyl-1-propenyl)furan 81.82
C00010371 Yomogi alcohol
Yomogi alcohol A
2,5,5-Trimethyl-3,6-heptadien-2-ol
81.82
C00010466 Chrysanthemol
Chrysanthemyl alcohol
81.82
C00010467 Grandisol 81.82
C00010468 Fragranol 81.82
C00010470 Junionone 81.82
C00010881 trans-p-Mentha-1(7),8-dien-3-ol 81.82
C00010890 (+)-Isopiperitenone
p-Mentha-1,8-dien-3-one
81.82
C00010929 1-Terpinen-5-ol 81.82
C00010938 Isopulegol
(-)-Isopulegol
81.82
C00010939 (+)-Neoisopulegol 81.82
C00010941 (-)-Piperitone 81.82
C00010948 (+)-Isopulegone
(2R-trans)-5-methyl-2-(1-methylethenyl)-cyclohexanone
81.82
C00011056 5,6-Dimethyl-5-norbornen-exo-2-ol 81.82
C00016057 Pulchellalactam
Z-Pulchellalactam
(Z)-Pulchellalactam
81.82
C00018017 Dihydrosarkomycin
NSC 409561
81.82
C00029355 CID is old! 81.82
C00029973 CID is old! 81.82
C00031068 alpha-Phellandren-8-ol
p-Mentha-1,5-dien-8-ol
81.82
C00032638 3,5-Dimethyl-4-hydroxy benzaldehyde
4-Hydroxy-3,5-dimethylbenzaldehyde
81.82
C00034465 cis-Chrysanthemol
cis-Chrysanthemyl alcohol
81.82
C00034575 Lavandulol 81.82
C00034726 trans-Chrysanthemyl alcohol 81.82
C00035737 Safranal 81.82
C00047172 Ampelomin A
(+)-Ampelomin A
81.82
C00048331 beta-Terpineol 81.82
Page Top