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


and

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




INPUT WORD = C00022287 , 50% or more
[ Metabolite Name : Ballonigrin , Ballonigrine ]
Number of matched data : 56

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00022288 Ballonigrinone 96.23
C00022289 18-Hydroxyballonigrine 96.23
C00022391 Ballotinone
7-Oxomarrubiin		 94.34
C00030660 Limbatenolide D 94.23
C00003452 Marrubiin 94.12
C00048283 3alpha-Hydroxymarrubiin
(+)-3alpha-Hydroxymarrubiin		 92.45
C00022394 Ballotenol 92.31
C00030661 Limbatenolide E
(+)-Limbatenolide E		 92.31
C00022271 7-Hydroxylambertianic acid 92.16
C00022294 Marrubenol 92.16
C00023370 Galeopsitrione 92.16
C00031960 Leoheterin
(+)-Leoheterin		 92.16
C00022266 Peregrinin 90.57
C00023367 Isodihydroclutiolide 90.57
C00041663 Marrulibanoside 90.57
C00022383 15,16-Epoxy-20-oxo-8(17),13(16),14-labdatrien-19-oic acid methyl ester 90.38
C00023347 (13S)-Premarrubiin 90.38
C00023350 Sciadin 90.38
C00022197 Jhanic acid 90.20
C00022229 ent-2alpha-2,18-Dihydroxy-8(17),13-labdadien-15,16-olide 90.20
C00022272 17-Hydroxyisolambertianic acid 90.20
C00022314 (+)-Isomatrine
Isomatrine		 90.20
C00022320 Polyalthic acid 90.20
C00022321 Lambertianic acid 90.20
C00022769 ent-8(17),13-Labdadien-15,16-olid-18-oic acid 90.20
C00022770 Pinusolidic acid 90.20
C00023344 Nivenolide 90.20
C00023396 Haplomitrenolide A 90.20
C00023461 Gutierrezial 90.20
C00031965 Leoheteronin E
(-)-Leoheteronin E
Isoleopersin G		 90.20
C00036103 Cornutin I
(+)-Cornutin I		 90.20
C00043600 Hypopurin A
(+)-Hypopurin A		 90.20
C00043603 Hypopurin D
(+)-Hypopurin D		 90.20
C00050374 Leopersin G
(+)-Leopersin G		 90.20
C00022429 Rupestralic acid 89.09
C00022392 Leonotin 88.68
C00023366 Dihydroclutiolide 88.68
C00035425 Velutine C 88.68
C00003476 (13R)-Premarrubiin 88.46
C00022329 Austrochaparol acetate 88.46
C00022771 Pinusolide 88.46
C00023363 Wightionolide 88.46
C00022230 Phlogantholide A 88.24
C00022232 14-Deoxyandrographolide 88.24
C00022240 14-Deoxy-11,14-didehydroandrographolide 88.24
C00022268 Hispanolone 88.24
C00022307 7-Hydroxyhedychenone 88.24
C00022312 (-)-Isopsiadiol 88.24
C00022322 Illurinic acid
Daniellic acid		 88.24
C00022457 ent-Labda-8(17),13-dien-19-oic acid-15,16-olide 88.24
C00023369 Galeopsinolone 88.24
C00035728 Preleoheterin 88.24
C00041483 Deacetylvitexilactone
(+)-Deacetylvitexilactone		 88.24
C00045082 Sterebin K
(+)-Sterebin K		 88.24
C00045083 Sterebin L 88.24
C00049927 1-Deoxybacrispine 88.24
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