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


and

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




INPUT WORD = C00011976 , 50% or more
[ Metabolite Name : 11,13-Dehydromelitensin diacetate ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011756 Millefin 98.04
C00011977 Isoarbutifolin 96.08
C00020506 8alpha-Acetoxyzaluzanin D 94.23
C00011784 Carmelin 94.12
C00011998 [3aR-[3aalpha,4beta(Z),6alpha,7beta,7abeta]]-6-Ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 92.45
C00011999 [3aR-[3aalpha,4beta(E),6alpha,7beta,7abeta]]-6-ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 92.45
C00003243 Cynaropicrin 92.31
C00003366 Saupirin
sauparine		 92.31
C00012962 Armexin
[3aS-(3aalpha,5abeta,6alpha,8alpha,9balpha)]-6,8-bis(acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 92.31
C00021690 Hysterin acetate 92.31
C00011804 Sintenin 92.16
C00011823 Idomain 92.16
C00034536 Hierapolitanin A
(+)-Hierapolitanin A		 92.16
C00013086 Trichomatolide B
[3aR-[3aalpha,4beta(E),5abeta,6beta,8alpha,9aalpha,9bbeta]]-Dodecahydro-6,8-dihydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.74
C00035790 3,15-Di-O-acetyl-9beta-hydroxyamphoricarpolide 90.74
C00020486 8-Acetoxy-4-anhydroathamontanolide 90.38
C00020513 Dehydrocyanaropicrin 90.38
C00021076 Cumanin diacetate 90.38
C00021092 Ligulatin C 90.38
C00021783 2beta,5alpha-Diacetoxy-9(12)-capnellene-8beta,10alpha-diol 90.38
C00021787 13beta,14-Diacetoxy-9(12)-capnellene-8beta,10alpha-diol 90.38
C00003229 Chamissonin diacetate 90.20
C00003386 Vernoflexin
Vernoflexine
Zaluzanin C senecioate		 90.20
C00011803 3beta-Acetoxyhaageanolide acetate 90.20
C00011814 Zexbrevin D 90.20
C00011857 Vernopectolide B 90.20
C00011981 Zinarosin 90.20
C00011982 [3aS-(3aalpha,4beta,5beta,6alpha,7abataethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 90.20
C00012059 Dicotomentolide 90.20
C00012847 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(3-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 90.20
C00012850 Decahydro-alpha,4a-dimethyl-8-methylene-7-(3-methyl-1-oxobutoxy)-2-naphthaleneacetic acid 90.20
C00020511 Aguerin A 90.20
C00020512 Aguerin B 90.20
C00022606 11beta,13-Dihydroarbutifolin 90.20
C00012058 (+)-20-Hydroxyelemajurinelloide 89.09
C00012984 (+)-Tirotundifolin A
Tirotundifolin A		 89.09
C00020795 [3aR-[3aalpha,4beta(R*),6aalpha,9aalpha,9bbeta]]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-9-methyl-3,6-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2,5-dihydro-5-hydroxy-3-furancarboxylic acid 89.09
C00022664 8beta-Acetoxy-3beta-propionyloxyisocostic acid methyl ester 89.09
C00003384 Vernodalin 88.89
C00012061 11,13-Dihydrovernodalin 88.89
C00012114 Ladibranolide 88.89
C00012976 (+)-Tirotundifolin C
Tirotundifolin C
(3aR,4R,5aR,6R,9aS,9bR)-[partial]- 2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 88.89
C00012977 Tirotundifolin D
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2-(hydroxymethyl)-2-butenoic acid		 88.89
C00012986 Trichomatolide D
(3aR,4R,5aR,6R,9aS,9bR)-[partial]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 88.89
C00012987 Trichomatolide E
[3aR-[3aalpha,4beta(E),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-(hydroxymethyl)-2-butenoic acid		 88.89
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		 88.89
C00013089 Eudesmaafraglaucolide
[5aR-(5aalpha,6alpha,8alpha,9abeta,9balpha)]-8-(Acetyloxy)-3-[(acetyloxy)methyl]-5,5a,6,7,8,9,9a,9b-octahydro-6-hydroxy-5a-methyl-9-methylenenaphtho[1,2-b]furan-2(4H)-one		 88.89
C00020505 Epicentaurepensin
Linichlorin B		 88.89
C00020850 Acrorepiolide 88.89
C00030653 Leucasdin B
(-)-Leucasdin B		 88.89
C00039365 Helivypolide D 88.89
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