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


and

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




INPUT WORD = C00022663 , 50% or more
[ Metabolite Name : 8beta-Acetoxy-3beta-angeloyloxy-isocostic acid methyl ester ]
Number of matched data : 54

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00022673 8beta-Acetoxy-3beta-angeloyloxy-5alpha-hydroxycostic acid methyl ester 95.08
C00022672 8beta-Acetoxy-3beta-angeloyloxy-5alpha-hydroperoxycostic acid methyl ester 92.06
C00003313 Laserolide 91.53
C00011973 Isolaserolide 91.53
C00022664 8beta-Acetoxy-3beta-propionyloxyisocostic acid methyl ester 91.53
C00012952 [3aR-[3aalpha,4alpha(E),6beta,8alpha,8aalpha,9aalpha]]-8-(acetyloxy)-2,3,3a,4,6,7,8,8a,9,9a-Decahydro-6-hydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 90.00
C00011986 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]-7-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 89.83
C00013009 Isosilerolide
[3S-[3alpha(Z),3aalpha,5aalpha,6beta,9abeta,9balpha]]-6-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid		 89.83
C00003274 Eupaserrin 88.14
C00011987 [3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]-4-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 88.14
C00012279 Linearilobin I 88.14
C00012400 Jamaicolide D 88.14
C00012702 Pluchecinin 88.14
C00021354 Bakkenolide E 88.14
C00022671 3beta-Angeloyloxy-5alpha-hydroperoxycostic acid methyl ester 88.14
C00003261 Erioflorin methacrylate 87.10
C00012307 Calein B 86.89
C00022582 6alpha-Angeloyloxy-4alpha-hydroxy-3,4,13,14-tetrahydrokolavenic acid 86.89
C00011881 Longipilin 86.67
C00022211 Conyzanol A 86.67
C00022347 Varodiol diacetate 86.67
C00034538 Hierapolitanin C
(+)-Hierapolitanin C		 86.67
C00038577 Bakkenolide H
(-)-Bakkenolide H		 86.67
C00010964 [1S-[1alpha(E),3(E),5beta,6alpha]]-5-(acetyloxy)-6-(1-methylethyl)-3-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]-4-oxo-2-cyclohexen-1-yl ester 86.44
C00013007 Inucrithmolide
[3R-[3alpha,3abeta,5alpha,5aalpha,6beta(Z),9aalpha,9bbeta]]-5-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-6-yl ester 2-methyl-2-butenoic acid		 86.44
C00013010 Silerolide
[3S-(3alpha,3aalpha,5aalpha,6beta,9abeta,9balpha)]-6-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 3-methyl-2-butenoic acid		 86.44
C00013087 Trichomatolide C
[3aR-[3aalpha,4beta(E),5abeta,6beta,8alpha,9bbeta]]- 2,3,3a,4,5,5a,6,7,8,9b-Decahydro-6,8-dihydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 86.44
C00020991 Clementein 86.44
C00020992 Clementein B 86.44
C00020993 Clementein C 86.44
C00021353 Bakkenolide B
Fukinolide		 86.44
C00021356 Dihydrofukinolide 86.44
C00022666 3beta-Angeloyloxyisocostic acid methyl ester 86.44
C00023200 3alpha-Angeloyloxy-ent-labda-7,13E-dien-2beta,15-diol 86.44
C00034537 Hierapolitanin B
(+)-Hierapolitanin B		 86.44
C00038285 5,8-Epoxy-9-acetoxysinulariolide
(+)-5,8-Epoxy-9-acetoxysinulariolide		 86.44
C00038576 Bakkenolide G
(-)-Bakkenolide G		 86.44
C00041357 Asbestinin 24
(+)-Asbestinin 24		 86.44
C00041515 Emblide
(+)-Emblide		 86.44
C00049254 Parguerol 86.44
C00003315 Liatrin 85.48
C00029222 Vilmorrianone
(-)-Vilmorrianone		 85.48
C00039008 Diacarperoxide G
(+)-Diacarperoxide G		 85.48
C00003404 Asebotoxin II 85.25
C00011854 Acanthoglabrolide 85.25
C00020589 Berlandin 85.25
C00020939 Macrocliniside C 85.25
C00021396 Pallinin 85.25
C00022499 Methyl ent-16-acetoxy-6,13E-labdadien-15,17-dioate 85.25
C00023411 3alpha-Angeloyloxy-18-hydroxy-ent-labd-8(17)-13E-dien-15-oic acid 85.25
C00036566 4'-Acetylcnicin 85.25
C00037717 Rabdoternin D
(-)-Rabdoternin D		 85.25
C00041358 Asbestinin-25
(+)-Asbestinin-25		 85.25
C00042546 Gelomulide B 85.25
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