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


and

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




INPUT WORD = C00036460 , 50% or more
[ Metabolite Name : 2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one , 2,4-Dihydroxy-1,4-benzoxanzin-3(4H)-one , DIBOA ]
Number of matched data : 63

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00036489 2-Hydroxy-1,4-benzoxanzine-3(2H)-one
2-Hydroxy-1,4-benzoxazin-3-one
HBOA		 92.59
C00036575 4-Hydroxy-2H-1,4-benzoxazin-3(4H)-one 92.59
C00007512 4-Hydroxyphenylpyruvate
p-Hydroxyphenylpyruvic acid		 88.89
C00028066 Clausamide II 88.89
C00026498 DIMBOA
2,4-dihydroxy-7-methoxy-1,4-benzoxazin-3-one
(+/-)-2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one		 87.10
C00036461 CID is old! 87.10
C00031720 Danshensu
3,4-Dihydroxyphenyllactic acid		 85.71
C00033510 1-(2-Hydroxy-5-methoxyphenyl)-1,2-propanediol 85.71
C00040202 Salvianic acid A
(+)-Salvianic acid A		 85.71
C00000150 D-beta-Phenyllactic acid 85.19
C00001397 L-Tyrosine
L-Tyr		 85.19
C00026244 Glycosmicine
1,2,3,4-Tetrahydro-1-methyl-2,4-dioxoquinazoline
1-Methyl-2,4(1H,3H)-quinazolinedione
1-Methyl-2,4-quinazolinedione		 85.19
C00029643 Adrenaline
Adrenalin		 85.19
C00030483 Hippuric acid 85.19
C00031463 (4R)-4,8-Dihydroxy-alpha-tetralone 85.19
C00036627 Coixol
6-Methoxybenzoxazolin-2(3H)-one
6-Methoxy-benzoxazolin-2(3H)-one
MBOA		 85.19
C00040794 2,6-Dimethoxy-benzoic acid 85.19
C00041264 3-(Hydroxyacetyl)indole 85.19
C00000119 4-Hydroxymellein 82.76
C00020088 3,4,-Dihydro-6-hydroxy-4,7-dimethyl-2H-1-benzopyran-2-one 82.76
C00029969 cis-4-Hydroxymellein
cis-3S,4S-4-Hydroxymellein		 82.76
C00030545 Isosafrol glycol 82.76
C00045560 3-Deoxyisoochracinic acid
(-)-3-Deoxyisoochracinic acid		 82.76
C00001357 3,4-Dihydroxyphenylalanine
Dihydroxyphenylalanine
L-Dopa
L-DOPA
DOPA
Levodopa		 82.14
C00002695 2',6'-Dihydroxy-4'-hydroxyacetophenone 82.14
C00016531 Cremeomycin 82.14
C00018170 Forphenicine 82.14
C00029477 3,4'-Dihydroxy-3'-methoxypropiophenone
3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone
beta-Hydroxypropiovanillone
beta-Hydroxypropiovanillone
omega-Hydroxypropioguaiacone		 82.14
C00034393 4-(2-Hydroxyphenyl)-4-oxobutyric acid 82.14
C00046137 Methyl 2-(4-methoxyphenyl)-2-oxoacetate 82.14
C00048196 Terricolyne 82.14
C00000100 Indole-3-acetic acid
Indoleacetic acid
IAA
Indole-3-acetate		 81.48
C00000550 (R)-(-)-Mellein
Mellein
Ochracin		 81.48
C00000580 (E)-p-Coumaric acid
trans-4-Hydroxycinnamic acid
trans-p-Coumaric acid
trans-p-Hydroxycinnamic acid		 81.48
C00000751 Phenylpyruvic acid 81.48
C00001354 L-2,5-Dihydrophenylalanine 81.48
C00001386 L-Phenylalanine
L-Phe
Phenylalanine		 81.48
C00002694 2',6'-Dihydroxy-4'-methoxyacetophenone 81.48
C00002704 Paeonol 81.48
C00002729 2-Hydroxycinnamic acid
o-Coumaric acid
O-coumaric acid		 81.48
C00002756 Melilotic acid 81.48
C00007577 1-Methoxyindole-3-carbaldehyde 81.48
C00007579 Indole 3-carboxylic acid methyl ester 81.48
C00016245 2'-Carbamoylacetanilide
2-(Acetylamino)benzamide
2-Acetamidobenzamide
NP 101A
o-Acetamidobenzamide		 81.48
C00026242 Glomerin
,2-Dimethyl-4(1H)-quinazolone
1,2-Dimethyl-4-oxoquinazoline		 81.48
C00026316 4-Hydroxycinnamate 81.48
C00029338 (E)-Methyl 3-(4-hydroxyphenyl)acrylate
(E)-Methyl-4-hydroxycinnamate		 81.48
C00029471 3-(4-Hydroxyphenyl)propionic acid
4-Hydroxydihydrocinnamic acid
Dihydro-p-coumaric acid		 81.48
C00029479 3,4-dimethoxybenzoic acid
Veratric acid		 81.48
C00029578 6-Methoxyindoline-2,3-dione 81.48
C00030768 Methyl vanillate 81.48
C00031034 Piperonylic acid
3,4-Methylenedioxybenzoic acid		 81.48
C00031466 (4S)-4,8-Dihydroxy-alpha-tetralone 81.48
C00035885 Tropic acid 81.48
C00035926 CID is old! 81.48
C00037118 erythro-Anethole glycol 81.48
C00037455 Lysichitalexin
2-(4-Methyloxyphenyl)-1-nitroethane		 81.48
C00037676 p-Propoxy benzoic acid 81.48
C00037913 threo-Anethole glycol
Anethole glycol		 81.48
C00037926 trans-2-Phenylcyclopropane-1-carboxylic acid 81.48
C00039440 Isoferulaldehyde 81.48
C00044987 p-(Acetylamino)benzoic acid 81.48
C00045185 5-Hydroxy-3-(2-hydroxyethyl)-indole 81.48
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