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


and

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




INPUT WORD = C00030661 , 50% or more
[ Metabolite Name : Limbatenolide E , (+)-Limbatenolide E ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00041663 Marrulibanoside 96.23
C00022769 ent-8(17),13-Labdadien-15,16-olid-18-oic acid 94.23
C00022391 Ballotinone
7-Oxomarrubiin		 92.45
C00022392 Leonotin 92.45
C00048283 3alpha-Hydroxymarrubiin
(+)-3alpha-Hydroxymarrubiin		 92.45
C00003452 Marrubiin 92.31
C00022229 ent-2alpha-2,18-Dihydroxy-8(17),13-labdadien-15,16-olide 92.31
C00022287 Ballonigrin
Ballonigrine		 92.31
C00022457 ent-Labda-8(17),13-dien-19-oic acid-15,16-olide 92.31
C00023347 (13S)-Premarrubiin 92.31
C00023350 Sciadin 92.31
C00030660 Limbatenolide D 92.31
C00032063 Neocaesalpin I
(+)-Neocaesalpin I		 92.31
C00041483 Deacetylvitexilactone
(+)-Deacetylvitexilactone		 92.31
C00022266 Peregrinin 90.57
C00022288 Ballonigrinone 90.57
C00022289 18-Hydroxyballonigrine 90.57
C00035425 Velutine C 90.57
C00003476 (13R)-Premarrubiin 90.38
C00022272 17-Hydroxyisolambertianic acid 90.38
C00022294 Marrubenol 90.38
C00022314 (+)-Isomatrine
Isomatrine		 90.38
C00022320 Polyalthic acid 90.38
C00022321 Lambertianic acid 90.38
C00022383 15,16-Epoxy-20-oxo-8(17),13(16),14-labdatrien-19-oic acid methyl ester 90.38
C00022394 Ballotenol 90.38
C00022413 Medigenin 90.38
C00022768 7,13-Labdadien-15,16-olid-19-oic acid 90.38
C00022770 Pinusolidic acid 90.38
C00022771 Pinusolide 90.38
C00023344 Nivenolide 90.38
C00023363 Wightionolide 90.38
C00023396 Haplomitrenolide A 90.38
C00023444 Koanophyllic acid D 90.38
C00023461 Gutierrezial 90.38
C00030462 Hedyforrestin D 90.38
C00032544 Yunnancoronarin C 90.38
C00036103 Cornutin I
(+)-Cornutin I		 90.38
C00043600 Hypopurin A
(+)-Hypopurin A		 90.38
C00043603 Hypopurin D
(+)-Hypopurin D		 90.38
C00050374 Leopersin G
(+)-Leopersin G		 90.38
C00022217 Leonotinin 88.89
C00031513 15-Methoxypinusolidic acid
(+)-15-Methoxypinusolidic acid		 88.89
C00035207 15-epi-Cyllenine A 88.89
C00035287 Cyllenine A 88.89
C00041247 15-epi-Cyllenin A 88.89
C00041472 Cyllenin A 88.89
C00043601 Hypopurin B
(+)-Hypopurin B		 88.89
C00048251 13S-Preperegrinine
(+)-13S-Preperegrinine		 88.89
C00023367 Isodihydroclutiolide 88.68
C00034129 Phanginin I
(+)-Phanginin I		 88.68
C00036099 Cornutin E
(-)-Cornutin E		 88.68
C00043602 Hypopurin C
(+)-Hypopurin C		 88.68
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