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


and

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





INPUT WORD = C00050239 , 50% or more
[ Metabolite Name : 4-Methylsulfinylbutyl isothiocyanate , Sulforaphane ]
Number of matched data : 75

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00000772 7-Mercaptoheptanoic acid
7-Thioheptanoic acid
84.21
C00029463 2-Nonanone
Nonan-2-one
84.21
C00047246 Iberin 84.21
C00031764 Entadamide C 80.95
C00002047 (-)-Hygroline
Hygroline
80.00
C00002062 Pelletierine
(-)-Pelletierine
80.00
C00036318 (+)-Physoperuvine 80.00
C00046982 (+)-Allosedridine 80.00
C00001231 Octanoic acid
Caprylic acid
n-Octanoic acid
78.95
C00007400 5-Methylthiopentanaldoxime 78.95
C00028721 Norhygrine
N-Demethylhygrine
78.95
C00031763 Entadamide A 78.95
C00033589 7-Octene-1,6-diol 78.95
C00034756 (E,E)-2,4-Nonadienal 78.95
C00034881 N-Methylproline
N-Methyl-L-proline
(-)-N-Methyl-L-proline
78.95
C00035503 4-Nonanol 78.95
C00035504 4-Nonanone 78.95
C00035612 Ethyl hexanoate
Ethyl caproate
78.95
C00035701 1-Hexyl acetate
n-Hexyl acetate
Hexyl acetate
78.95
C00035766 (E)-2-Hexenyl acetate
trans-2-Hexenyl acetate
78.95
C00036454 2,4,5,7-Tetrathiaoctane 2-oxide 78.95
C00049076 2-Acetonyl-3,5-dihydroxy-7-methoxy-1,4-naphthoquinone 78.95
C00000309 Raphanusanin 77.27
C00002120 Supinidine 76.19
C00002299 Physoperuvine 76.19
C00002301 Pseudotropine 76.19
C00002306 Tropine 76.19
C00007399 6-Methylthiohexanaldoxime 76.19
C00007594 Dihomomethionine 76.19
C00007648 2-Oxo-6-methylthiohexanoic acid
6-Methylthio-2-oxohexanoic acid
76.19
C00026165 7alpha-Hydroxy-1-methylene-8alpha-pyrrolizidine 76.19
C00026172 7beta-Hydroxy-1-methylene-8alpha-pyrrolizidine 76.19
C00029453 2-Decanol
2-Hydroxydecane
76.19
C00034760 2-Decanone 76.19
C00037960 Tropinone 76.19
C00002046 Hygrine
(+)-Hygrine
D-(+)-Hygrine
75.00
C00002064 Pinidine 75.00
C00002068 Pseudoconhydrine 75.00
C00002074 Stachydrine 75.00
C00018814 Desdanine
CAM
Cyclamidomycin
NSC 121234
Pyracrimycin A
75.00
C00038666 Butiin
(+)-Butiin
73.91
C00000210 CID is old! 73.68
C00000334 Cyclohexylcarboxylic acid
Hexahydrobenzoic acid
73.68
C00001242 Allicin 73.68
C00001264 1-Octanol
Octan-1-ol
Octanol
n-Octanol
73.68
C00001317 (E,Z)-2,6-Nonadienal
Nona-2,6-dienal
(2E,6Z)-Nona-2,6-dienal
73.68
C00001387 L-Pipecolic acid
Pipecolic acid
73.68
C00001404 N-Carbamoylputrescine 73.68
C00002030 gamma-Coniceine 73.68
C00002031 Coniine
(+)-Coniine
73.68
C00002043 Guvacine 73.68
C00007414 2-Ethylhexanoic acid 73.68
C00007476 5-(Methylthio)-2-oxo-pentanoic acid 73.68
C00007610 4-Metyl-5-(beta-hydroxyethyl)thiazole
4-methyl-5-(2hydroxyethyl)thiazole
73.68
C00007667 5-Methylsufinylpentyl nitrile 73.68
C00010304 (E)-(R)-(-)-2,6-Dimethyl-1,4,7-octatriene 73.68
C00010859 Isopropylcyclohexane 73.68
C00018286 Scorodonin 73.68
C00029316 (2E)-Octenal
trans-Oct-2-en-1-al
(E)-2-Octenal
trans-2-Octenal
73.68
C00029331 (2E)-2-Nonenal
(E)-Non-2-enal
(E)-2-Nonenal
(2E)-Non-2-enal
trans-2-Nonenal
trans-2-Nonen-1-al
73.68
C00029423 1-Octen-3-ol
Oct-1-en-3-ol
73.68
C00030828 Nonadienal
Nonanal
n-Nonanal
73.68
C00030830 Nonanol
n-Nonanol
1-Nonanol
73.68
C00030880 Octanal
n-Octanal
73.68
C00034233 Se-Methylselenomethionine 73.68
C00034882 Nonane
n-Nonane
73.68
C00035495 3-Octanol
Octan-3-ol
73.68
C00035546 Butyl butyrate 73.68
C00035928 3,5-Nonadiyne 73.68
C00036613 6-Deoxy-fagomine
(-)-6-Deoxy-fagomine
73.68
C00042095 2-Cyclohexylethylamine 73.68
C00042856 Pipecolamide 73.68
C00048315 alpha-Myrcene 73.68
C00048375 Decane 73.68
C00048964 cis-3-Hexenyl acetate
(Z)-3-Hexenyl acetate
73.68
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