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StructureChemical NameCASMF
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-2,2-dimethyl-3-[2-[2-(2-methylpropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid 15621-60-0 C25H42N7O17P3S
[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate 34692-44-9 C20H26N10O15P2
(3R,5S)-5-[(2R)-2-[(1R,3aR,4E,7aR)-4-[(2Z)-2-[(3S,5S)-3,5-dihydroxy-2-methylidene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]propyl]-3-hydroxy-3-methyl-oxolan-2-one 81203-50-1 C27H40O5
[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate 5542-28-9 C20H28N10O19P4
[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate 56432-02-1 C20H27N10O16P3
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxo-1,5-dihydrobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentoxy]-hydroxyphosphoryl] hydrogen phosphate 1910-41-4 C27H35N9O15P2
[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate 10527-47-6 C20H27N10O17P3
[(2R,3S,4R,5R)-5-acetamido-2,3,4-trihydroxy-6-oxohexyl] hydrogen sulfate 10356-99-7 C8H15NO9S
[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate 100849-67-0 C20H28N10O20P4
[[[[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate 78101-73-2 C20H29N10O24P5
Phenylacetyl-CoA 7532-39-0 C29H42N7O17P3S
[[[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate 56983-23-4 C20H30N10O25P6
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-2,2-dimethyl-3-[2-[2-(3-oxotetradecanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid 122364-86-7 C35H60N7O18P3S
(1R,2S,4R,6R)-2,4-Bis(tert-butyldiMethylsilyloxy)-1-Methyl-cyclohexane 1,2-Epoxide 121289-20-1 C19H40O3Si2
(2R,3S,4R,5R)-6-Benzyloxy-2,4-dimethylhexane-1,2,3,5-tetrol C15H24O5
(2R)-3-[[(2S)-2α-[(1R,2R)-4-Benzyloxy-2-(tert-butyldimethylsilyloxy)-1-methylbutyl]-5-methoxytetrahydrofuran]-3α-yl]-2-methyl-1-propanol
(2R,3S,4R,5R)-6-Benzyloxy-2,4-dimethylhexane-1,2,3,5-tetrol 3,5-diacetate C19H28O7
[4R-[3(2(S*),5(R*),4R]]-3-[2-[1-[3-[Bis(phenylmethyl)amino]phenyl]propyl]-5-hydroxy-1,3-dioxo-5-(2-phenylethyl)-6-octynyl]-4-phenyl-2-oxazolidinone 188559-22-0 C48H48N2O5
(2R,4S,5R)-2β-[(R)-Cinnamoyloxy(6-methoxy-4-quinolyl)methyl]-1-azabicyclo[2.2.2]octane-5β-methanol
RSSG1, Mouse
(1R,2S,4R,10R)-2,7-Dimethyl-10-(1-methylethenyl)-15-oxatricyclo[11.2.1.02,4]hexadeca-6,13(16)-diene-5,8,14-trione C20H24O4
(1R,3S,5R,7R)-3,5-Dimethyl-2,4,6,8-tetrathiatricyclo[3.3.1.13,7]decane-1-thiol
(1R,3S,5R,7R)-3,5-Dimethyl-2,4,6,8-tetrathiatricyclo[3.3.1.13,7]decane-1-carboxamide
(5R,6S,7R,8R)-5,7-Dimethyltridecane-6,8-diol C15H32O2
(1R,2S,3R,4R)-2,3-DIHYDROXY-4-(HYDROXYMETHYL)-1-AMINOCYCLOPENTANE HYDROCHLORIDE 79200-57-0 C6H14ClNO3
[(1R,2S,3R,4R)-3-(diethylaminomethyl)-1,7,7-trimethyl-norbornan-2-yl] N-(2-heptoxyphenyl)carbamate hydrochloride 149749-98-4 C29H49ClN2O3
7-[(1R,2S,3R,5R)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopent yl]heptanoic acid 28977-21-1 C20H36O5
(4R,8S,9R,12R)-7β,8:15,16-Diepoxy-12-hydroxy-10α,4-(oxycarbonyl)-3-norcleroda-13(16),14-dien-20-oic acid 20,12-lactone
(1R,3S,5R,7R)-5,7-Dimethyl-2-oxa-4,6-dithiaadamantane-1,3-diol C9H14O3S2
(1R,3S,4R)-rel-3,4-Difluorocyclohexane-1-carboxylic Acid 1346604-76-9 C7H10F2O2
(1R,2S,4R)-rel-1-Azabicyclo[2.2.1]heptane-2-carboxylic acid hydrochloride 921755-45-5 C7H12ClNO2
(1R,2S,5R,6R,9E,12S)-1,5,9-Trimethyl-12-isopropyl-15,16-dioxatricyclo[10.2.1.12,5]hexadec-9-en-6-ol
(2R,7S,8R)-2-[(1R,3E)-1-Chloro-5-hexyn-3-enyl]-7-bromo-8-ethyl-1-oxacycloocta-4-ene 81176-29-6
(3R,5S,5'S)-3',4,4',5,7',8'-Hexahydro-6'α,4'aα(8'aH)-(epoxymethano)-5-(furan-3-yl)-2'α-methyl-4'β,6'β,8'aβ-trihydroxydispiro[furan-3(2H),1'(2'H)-naphthalene-5'(6'H),2''-oxiran]-2-one
(2R,4S,5R)-4-[(1R)-1-(Ethoxycarbonyl)methyl-2-propenyl]-2-methyl-1,3-dioxan-5-ol C12H20O5
Fialuridine 69123-98-4 C9H10FIN2O5
1-[(2R,3S,4R,5R)-3-Fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione 69256-17-3 C10H13FN2O5
1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)uracil 69123-94-0 C9H11FN2O5
(2R,4S,5R)-2β-[(R)-Hydroxy(6-methoxy-4-quinolyl)methyl]-1-azabicyclo[2.2.2]octane-5β-methanol
(2R,5S,6R,10R)-6-Hydroxymethyl-10-methyl-2-(1-methylethenyl)spiro[4.5]decan-8-one C15H24O2
(1R,5S,7R,8R)-8-Hydroxy-7-hydroxymethyl-2,6-dioxabicyclo[3.3.0]octan-3-one C7H10O5
beta-D-Fructopyranose 7660-25-5 C6H12O6
(3R,4S,7S)-7β-[(1H-Indol-3-yl)methyl]-3α-isopropyl-4α-[(S)-3-methyl-2-(methylamino)butyrylamino]-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14(1),15-tetrene-5,8-dione 18867-84-0 C31H39N5O4
RTI-121, [125I]- C18H24INO2
RTI-55, [125I]- C16H20INO2
(1R,2S,3R,5S)-5-Acetyloxy-2-hydroxymethyl-3-tetrahydropyranyloxy-α-(phenylseleno)cyclopentaneheptanoic Acid Methyl Ester (Mixture of Diastereomers) C21H36O7
(1R,2S,3R,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carboxylic acid hydrochloride 1242184-45-7 C8H12ClNO2
(1R,2S,3R,4S)-2α-Amino-3β-phenylbicyclo[2.2.1]heptane-2β-carboxylic acid
(6R,7S,10R,11S)-6,6a,7,8,9,10,10a,11-Octahydro-6,11-dimethyl-12-phenyl-6,11-epimino-7,10-methano-5H-dibenz[b,e]azepine C23H26N2
(1R,2S,6R,7S)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene 5263-68-3 C9H13N
(2RS,3RS)-6-[A-(2-ETHOXY-D5-PHENOXY)BENZYL]MORPHOLIN-3-ONE C19H16D5NO4
(2RS,3RS)-6-[A-(2-ETHOXYPHENOXY)BENZYL]MORPHOLIN-3-ONE C19H21NO4
(2RS,3RS)-1-AMINO-3-(2-ETHOXY-D5-PHENOXY)-2-HYDROXY-3-PHENYLPROPANE, METHANESULFONATE SALT 1216592-04-9 C18H25NO6S
(1R,2S,3R)-(2-Quinoxalinyl)-1,2,3,4-butanetetrol 4711-06-2 C12H14N2O4
(2RS,3RS)-1-AMINO-3-(2-ETHOXYPHENOXY)-2-HYDROXY-3-PHENYLPROPANE, METHANESULFONATE SALT 93853-04-4 C18H25NO6S
(2RS,3RS)-2-AMINO-3-(3,4-DIHYDROXY-PHENYL)-3-HYDROXY-PROPIONIC ACID 3916-18-5 C9H11NO5
(3R,4S,5R,6S)-1-AZA-4-HYDROXY-5-FORMYL-6-ISOPROPYL-3-METHYL-7-OXABICYCL[3.3.0]OCTAN-2-ONE 145452-03-5 C11H17NO4
(3R,4S,5R,6S)-1-AZA-4-HYDROXY-5-HYDROXYMETHYL-6-ISOPROPYL-3-METHYL-7-OXABICYCL[3.3.0]OCTAN-2-ONE 145452-02-4 C11H19NO4
(2RS,2'RS)-AZOBIS(4-METHOXY-2,4-DIMETHYLVARERONITRILE) C16H28N4O2
[1R,2S,5R,6S,(-)]-Bicyclo[3.3.1]nonane-2β,6β-diol
(1R,2S,10R,11S)-2,11-Bis[(6-methoxyphenoxy)methyl]-3,6,9,12,15,18-hexaoxacyclooctadecane-1,10-bis(methanethiol) C30H44O10S2
(1R,4S)-3-[(1R,4S)-Bicyclo[2.2.1]heptan-2-ylidene]bicyclo[2.2.1]heptan-2-one C14H18O
(2RS,4RS)-2-(BROMOMETHYL)-2-(2,4-DICHLOROPHENYL)-1,3-DIOXOLANE-4-METHANOL BENZOATE ESTER C18H15BrCl2O4
(2R,3S,4R,5S)-1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triol C10H21NO4
(3R,4S,5R,6R)-1-(Methoxymethoxy)-3-ethyl-5-methyl-6-(tributylsiloxy)-8-(benzyloxy)-1-octen-4-ol C32H58O5Si
(1R,2S,4R,5S)-1,2,4,5-Cyclohexanetetrol C6H12O4
(2R)-3-[[(1S,2R,3S)-1-(Cyclohexylmethyl)-2,3-dihydroxy-5-methylhexyl]amino]-3-oxo-2-[(S)-2-(4-morpholinylsulfonylamino)-3-phenylpropanoylamino]propionic acid methyl ester C31H50N4O9S
(2R,4S,5R,6R)-4-methoxy-6-methyl-oxane-2,5-diol 579-04-4 C7H14O4
(2RS,3RS)-1-CHLOROACETYLAMINO-3-(2-ETHOXYPHENOXY)-2-HYDROXY-3-PHENYLPROPANE 93852-40-5 C19H22ClNO4
(1R,2S)-2-({[2-({[(1R,2S)-2-carboxycyclohexyl]carbonyl}anilino)ethyl]anilino}carbonyl)cyclohexanecarboxylic acid C30H36N2O6
(2RS,3RS)-1-CHLOROACETYLAMINO-3-(2-ETHOXY-D5-PHENOXY)-2-HYDROXY-3-PHENYLPROPANE 1184995-73-0 C19H18ClD5NO4
(8R,9S,13R,14R)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one 4248-04-8 C18H22O2
(2RS, 3RS)-2-(2,4-Difluorophenyl)-3-(5-fluoropyriMidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol)
9-[(1R,2S,3R,4S)-2,3-Dihydroxy-4-methylcyclopentyl]-1,6-dihydro-9H-purin-6-one 98873-79-1 C11H14N4O3
(1R,5S,7R,8S)-4,4-Diphenyltricyclo[6.2.0.03,7]deca-2,9-diene-5β-carbonitrile
(5R,6S,7R,8S)-5,7-Dimethyltridecane-6,8-diol C15H32O2
(1R,4S,5R,6S)-1,4-dimethyl-7-oxabicyclo[2.2.1]heptane-5,6-dicarboxylic acid 109282-37-3 C10H14O5
[(2R,3S,4R,6S)-4-dimethylamino-2-[[(1S,2E,5R,7R,8R,9S,10R,14S,15R,16R) -14-ethyl-10-hydroxy-1,5,9,15-tetramethyl-4,12-dioxo-7-(2-oxoethyl)-13 ,17-dioxabicyclo[14.1.0]heptadec-2-en-8-yl]oxy]-6-methyl-oxan-3-yl] bu tanoate 55103-30-5 C35H57NO10
7-[(1R,2S,3R,5S)-3,5-dihydroxy-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl] cyclopentyl]-6-oxo-heptanoic acid 68324-95-8 C20H32O6
(1R,2S,6R,7S)-4,4-DIMETHYL-3,5-DIOXA-8-AZATRICYCLO[5.2.1.0(2,6)]DECAN-9-ONE 220507-10-8 C9H13NO3
(1R,3S,4R,5S,6E,8R,10S)-1,7-Dimethyl-4-isopropyl-11-oxabicyclo[8.1.0]undec-6-ene-3,5,8-triol 3-trans-cinnamate 5-acetate C27H36O6
(2R,4S,5R)-4-[(1S)-1-(Ethoxycarbonyl)methyl-2-propenyl]-2-methyl-1,3-dioxan-5-ol C12H20O5
(6R,7S)-7-[[(2R,3S)-2-(4-Ethyl-2,3-dioxo-1-piperazinylcarbonylamino)-3-hydroxybutyryl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 76610-92-9
(2R,4S,5R,7S)-4,5-Epoxy-2,7-bis(2-phenylethyl)oxepane C22H26O2
(2RS,3RS)-3-(2-ETHOXYPHENOXY)-2-HYDROXY-1-(4-NITROBENZOYLOXY)-3-PHENYLPROPANE 98769-70-1 C24H23NO7
(2RS,3RS)-3-(2-ETHOXYPHENOXY)-2-METHANESULFONYLOXY-1-(4-NITROBENZOYLOXY)-3-PHENYLPROPANE 98854-88-7 C25H25NO9S
(2RS,3RS)-3-(2-ETHOXYPHENOXY)-1,2-DIHYDROXY-3-PHENYLPROPANE 98769-69-8 C17H20O4
(2RS,3RS)-3-(2-ETHOXY-D5-PHENOXY)-1,2-DIHYDROXY-3-PHENYLPROPANE 1276340-65-8 C17H15D5O4
(2RS,3RS)-3-(2-ETHOXYPHENOXY)-3-PHENYLPROPENE-1,2-EPOXIDE 98769-72-3 C17H18O3
(2RS,3RS)-3-(2-ETHOXY-D5-PHENOXY)-2-MESYLOXY-3-PHENYL-1-PROPANOL 1189680-85-0 C18H17D5O6S
(2R,3S,4R)-1-[(R)-1-Phenyl-2-hydroxyethyl]-2-cyano-4-(3-pyridinyl)pyrrolidine-3-carboxylic acid methyl ester C20H21N3O3
(3R,4S,5R,6R)-1-Phenyl-6-(hydroxymethyl)phosphorinane-2,3,4,5-tetrol C12H17O5P
(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[[3-[[[4-(AcetylaMino)phenyl]sulfonyl]MethylaMino]-3,4,6-trideoxy-β-D-xylo-hexopyranosyl]oxy]-13-[(2,6-dideoxy-3-C-Methyl-3-O-Methyl-α-L-ribo-hexo C45H77N3O15S
(2R,4S,5R,6S)-4-Hydroxy-2-methoxy-5-methyl-6-[(E)-1-methyl-1-butenyl]-tetrahydro-2H-pyran-2β-acetic acid methyl ester
(1R,2S,5R,6R,7R)-9-(α-Phenylbenzyl)tricyclo[4.2.1.02,5]non-3-ene-7α-carbonitrile
(2R,5S,6R,8R,10R)-8-Hydroxy-10-methyl-2-(1-methylethenyl)spiro[4.5]decane-6-methanol C15H26O2
(1R,3S,4R,6R,7R)-1,4,6-Trimethyl-3-[(1S,2E,4E,6E)-1-hydroxy-1-methyl-7-(4-methoxy-5-methyl-2-oxo-2H-pyran-6-yl)-2,4,6-heptatrien-1-yl]-2,5-dioxabicyclo[2.2.1]heptan-7-ol 100905-90-6 C23H30O7
(1R,3S,4R,6R,7R)-1,4,6-Trimethyl-3-[(1R,2E,4E,6E)-1-hydroxy-1-methyl-7-(4-methoxy-5-methyl-2-oxo-2H-pyran-6-yl)-2,4,6-heptatrien-1-yl]-2,5-dioxabicyclo[2.2.1]heptan-7-ol 101311-63-1
(1R,1'S,3'R/1R,1'R,3'S)-L-054,264 208706-12-1 C33H41N5O2
(2R,3S,4R,5R,8R,10R,11S,12R,13S,14R)-11-{[4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-2-ethyl-3,4,10-trihydroxy-13-[(5-hydroxy-4-methoxy-4,6-dimethyl
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