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


and

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




INPUT WORD = C00013552 , 50% or more
[ Metabolite Name : Axisothiocyanate 4 , (1R,3aR,7aR)-Octahydro-1-(1-isothiocyanato-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene ]
Number of matched data : 101

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013548 Axamide 4
N-[2-Methyl-1-[(1R,3aR,7aR)-octahydro-3a-methyl-7-methylene-1H-inden-1-yl]-1-propenyl]-formamide		 94.59
C00013549 Axisothiocyanate 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isothiocyanato-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 94.59
C00013244 Axamide 1
[1R-[1alpha(S*),3aalpha,7aalpha]]-N-[2-Methyl-1-(octahydro-3a-methyl-7-methylene-1H-inden-1-yl)propyl]formamide		 91.89
C00013550 Axisonitrile 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isocyano-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 91.89
C00013551 Axisonitrile 4
(1R,3aR,7aR)-Octahydro-1-(1-isocyano-2-methyl-1-propenyl)-3a-methyl-7-methylene-1H-indene		 91.89
C00021666 Acanthene B 91.89
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 89.19
C00012822 (1alpha,2beta,4aalpha,8aalpha)-Decahydro-1-isocyano-4a-methyl-8-methylene-2-(1-methylethyl)-naphthalene
6-Isocyano-4(15)-eudesmene		 89.19
C00012682 Acanthellin 1
[1S-(1alpha,2beta,4abeta,8alpha,8aalpha)]-Decahydro-1-isocyano-4a,8-dimethyl-2-(1-methylethenyl)naphthalene		 86.49
C00013555 Octahydro-1-(1-methoxy-2-methylpropyl)-3a-methyl-7-methylene-1H-inden-4-ol 86.49
C00031494 11-Methoxyopposit-4(15)-en-1beta-ol 86.49
C00039328 Halichonadin C
(-)-Halichonadin C		 86.49
C00038560 Axinisothiocyanate M
(-)-Axinisothiocyanate M		 84.62
C00021211 1-Isothiocyanatoaromadendrane 84.21
C00021243 10alpha-Isothiocyanatoalloaromadendrane 84.21
C00021244 Axisothiocyanate 2 84.21
C00021245 Epipolasin B 84.21
C00049930 2-(Formylamino)trachyopsane
(-)-2-(Formylamino)trachyopsane		 84.21
C00011922 Theonellin isothiocyanate 83.78
C00013553 (1R,3aR,4R,7aS)-Octahydro-3a-methyl-7-methylene-1-(2-methyl-1-propenyl)-1H-inden-4-ol
[1R-(1alpha,3abeta,4beta,7aalpha)]-octahydro-3a-methyl-7-methylene-1-(2-methyl-1-propenyl)-1H-inden-4-ol		 83.78
C00021242 Axisonitrile 2 83.78
C00021427 6-Isodaucene 14-isothiocyanate 83.78
C00021647 Axisothiocyanate 3 83.78
C00021648 Axisonitrile 3 83.78
C00021664 10-Isothiocyanatoguai-6-ene 83.78
C00021670 Axisocyanate 3 83.78
C00021978 9-Isocyanopupukeanane 83.78
C00021979 9-epi-9-Isocyanopupukeanane 83.78
C00046456 Teclenone B
(+)-Teclenone B		 83.78
C00002227 (+)-Matrine
Matrine		 82.05
C00007757 (-)-Sophoridine
Sophoridine		 82.05
C00023313 (+)-Allomatrine
6-Allomatrine
6beta-Matrine
Allmatrine
Tetrahydroisosophoramine		 82.05
C00013576 Epipolasin A
(1aR,3aS,7S,7aS,7bR)-Decahydro-7-isothiocyanato-1,1,3a,7-tetramethyl-1H-cyclopropa[a]naphthalene		 81.58
C00013577 (-)-Epipolasin A 81.58
C00020267 Uvidin A 81.58
C00020268 Uvidin C 81.58
C00021241 Axamide 2 81.58
C00002236 Sparteine
(+/-)-Sparteine
Spartein
(-)-Spartein		 81.08
C00003119 Cuauhtemone 81.08
C00003242 (+)-beta-Cyclocostunolide
beta-Cyclocostunolide[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-Decahydro-5a-methyl-3,9-bis(methylene)-naphtho[1,2-b]furan-2(3H)-one		 81.08
C00007689 11,12-Dehydrosparteine 81.08
C00011399 Kobusimin B 81.08
C00011544 Ancistrodial 81.08
C00011669 2,3-Epoxy-2,3-dihydro-1-bisabolone
[1alpha,3beta(S*),6alpha]-3-(1,5-Dimethyl-4-hexenyl)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-one		 81.08
C00011920 Theonellin formamide 81.08
C00011921 3-Isocyanotheonellin
Theonellin isocyanide		 81.08
C00012685 Heterocladol
[1R-(1a,4alpha,4aalpha,7alpha,8beta,8abeta)]-4-Bromo-8-chlorodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-naphthalenol		 81.08
C00012688 Isobrasudol
[2S-(2alpha,4abeta,5beta,8aalpha)]-5-Bromodecahydro-4a-methyl-8-methylene-2-(1-methylethyl)-2-naphthalenol		 81.08
C00012691 [1R-(1alpha,4alpha,4aalpha,7beta,8abeta)]-4-Bromo-7-chlorodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-naphthalenol 81.08
C00012714 Selina-4(14),7(11)-diene
Eudesma-4(14),7(11)-diene
(4aR-trans)-Decahydro-4a-methyl-1-methylene-7-(1-methylethylidene)naphthalene		 81.08
C00012722 7-Hydroxy-beta-costol
(+)-7-Hydroxycostol
Petrovin B
[2S-(2alpha,4abeta,8aalpha)]-Decahydro-2-hydroxy-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 81.08
C00012764 Ajanol
[1S-(1alpha,4aalpha,7alpha,8beta,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethyl)-1,8-naphthalenediol		 81.08
C00012778 Voleneol
Eudesm-4(15)-ene-1beta,6alpha-diol
1beta,6alpha-Dihydroxyeudesm-4(15)-ene
[1S-(1alpha,2beta,4abeta,5beta,8aalpha)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1,5-naphthalenediol		 81.08
C00012780 Platambin
[1S-(1alpha,2beta,4aalpha,5alpha,8abeta)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1,5-naphthalenediol		 81.08
C00012786 Kudtdiol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 81.08
C00012789 2-(1,4,4a,5,6,7,8,8a-Octahydro-4a,8-dimethyl-2-naphthalenyl)-1,2-propanediol 81.08
C00012796 Chenopotriol
[1R-(1alpha,2beta,4abeta,7alpha,8aalpha)]-Decahydro-2-(1-hydroxy-1-methylethyl)-4a-methyl-8-methylene-1,7-naphthalenediol		 81.08
C00012797 [1R-(1alpha,2beta,4abeta,7beta,8aalpha)]-Decahydro-2-(1-hydroxy-1-methylethyl)-4a-methyl-8-methylene-1,7-naphthalenediol
3-epi-Chenopotriol		 81.08
C00012799 (+)-Kudtriol
Kudtriol
Kutdtriol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 81.08
C00012800 5-epi-Kudtriol
5-epi-Kutdtriol
[2R-[2alpha(R*),4aalpha,8aalpha]]-2-(Decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 81.08
C00012808 beta-Verbesinol
[1R-(1alpha,2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenol		 81.08
C00012887 Asterolide
Atractylenolide II
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 81.08
C00012888 8-Epiasterolide
[4aS-(4aalpha,8abeta,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 81.08
C00013032 [3aR-(3aalpha,5abeta,9abeta,9bbeta)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one
ent-cis-beta-Cyclocostunolide		 81.08
C00013033 Critonilide
[3aR-(3aalpha,5aalpha,9abeta,9balpha)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 81.08
C00013034 (+)-beta-Frullanolide
[3aR-(3aalpha,5abeta,9aalpha,9balpha)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 81.08
C00013035 Morifolin B
[3aS-(3aalpha,5aalpha,9aalpha,9bbeta)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 81.08
C00013554 [1R-(1alpha,3abeta,4beta,7aalpha)]-Octahydro-3a-methyl-7-methylene-1-(2-methyl-2-propenyl)-1H-inden-4-ol 81.08
C00013557 Oppositol
(3S,3aS,4R,7S,7aS)-7-Bromooctahydro-4,7a-dimethyl-3-(2-methyl-1-propenyl)-1H-inden-4-ol		 81.08
C00013569 (+)-Brothenolide
Brothenolide
(3aR,5aR,6aS,7aS,7bS,7cS)-Decahydro-5a,7a-dimethyl-3-methylenecycloprop[2,3]indeno[4,5-b]furan-2(3H)-one		 81.08
C00013571 Crispatanolide
(3R,4aS,4bR,5aR,6aR)-Hexahydro-4b-methyl-3-(1-methylethyl)-3H-3,6a-ethano-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyran-1-one		 81.08
C00013572 Torilenol
(1R,1aR,1bS,5R,5aR,6aR)-Decahydro-5a-methyl-2-methylene-1-(1-methylethyl)cycloprop[a]inden-5-ol		 81.08
C00016980 cis-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylenenaphthaleneacetic acid methyl ester 81.08
C00017465 (+)-Chiloscypholone
Chiloscypholone		 81.08
C00020115 1-Isothiocyanato-4-muurolene 81.08
C00020278 Isoalbrassitriol 81.08
C00021210 1-Isocyanoaromadendrane 81.08
C00021288 Scariodione 81.08
C00021293 Anhydrovalerenenol 81.08
C00021344 Porellapinguisenone 81.08
C00021426 6-Isodaucene 14-isonitrile 81.08
C00021601 Hurgadol 81.08
C00021623 Obtusane 81.08
C00021645 Acanthisothiocyanate 3 81.08
C00021646 Axamide 3 81.08
C00021665 10-Isothiocyanato-4-cadinene 81.08
C00021668 (1R,6S,7S,10S)-10-Isothiocyanato-4-amorphene
10-Isothiocyanato-4-amorphene		 81.08
C00021977 2-Isocyanopupukeanane 81.08
C00033538 1beta,4beta,7alpha-Trihydroxyeudesmane
(-)-1beta,4beta,7alpha-Trihydroxyeudesmane		 81.08
C00036302 (+)-Dihydrochiloscypholone 81.08
C00037050 Dihydro-beta-Cyclocostunolide 81.08
C00038054 (-)-Eudesm-7(11)-en-4alpha-ol
Juniper camphor		 81.08
C00038340 9-Deoxyelatol
(+)-9-Deoxyelatol		 81.08
C00038558 Axinisothiocyanate K
(+)-Axinisothiocyanate K		 81.08
C00038562 Axinynitrile A
(+)-Axinynitrile A		 81.08
C00038809 Clypeotriol
(+)-Clypeotriol		 81.08
C00039842 Nepalensolide A 81.08
C00043115 Vittatalactone 81.08
C00046272 Pannosanol
(+)-Pannosanol		 81.08
C00046455 Teclenone A
(+)-Teclenone A		 81.08
C00047110 Trichocarane C
(-)-Trichocarane C		 81.08
Page Top