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    中文名称 英文名称 CAS号 化学式 结构式图片
    —— 2-oxo-6-selenocyanatomethyl-4-o-tolyl-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester 1609955-99-8 C16H17N3O3Se
    2-oxo-6-selenocyanatomethyl-4-o-tolyl-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester
    —— ethanedioic acid 1,2-bis(1,3,3-trimethylbicyclo[2.2.1]hept-2-yl)ester 124118-33-8 C22H34O4
    ethanedioic acid 1,2-bis(1,3,3-trimethylbicyclo[2.2.1]hept-2-yl)ester
    —— (R,S)-N6,N6-(2,3-dihydroxybutan-1,4-diyl)-2'-deoxyadenosine 1197991-92-6 C14H19N5O5
    (R,S)-N6,N6-(2,3-dihydroxybutan-1,4-diyl)-2'-deoxyadenosine
    —— 3-bromo-benzoic acid-(1-phenyl-2-pyrrolidino-ethyl ester); hydrochloride 109938-90-1 C19H20BrNO2*ClH
    3-bromo-benzoic acid-(1-phenyl-2-pyrrolidino-ethyl ester); hydrochloride
    —— methyl 2-(benzyloxy)-6-iodobenzoate 1383707-91-2 C15H13IO3
    methyl 2-(benzyloxy)-6-iodobenzoate
    —— (1R,2R)-N1,N2-bis((R)-1-(1H-pyrrol-2-yl)ethyl)cyclohexane-1,2-diamine 1206905-98-7 C18H28N4
    (1R,2R)-N1,N2-bis((R)-1-(1H-pyrrol-2-yl)ethyl)cyclohexane-1,2-diamine
    —— Methyl-<2.4-diphenoxy-butyrat> 101595-34-0 C17H18O4
    Methyl-<2.4-diphenoxy-butyrat>
    —— trans-(1R<sup>*</sup>,2R<sup>*</sup>)-2-(4-bromophenyl)-1-methoxy-2-phenylcyclopentane 129315-99-7 C18H19BrO
    trans-(1R<sup>*</sup>,2R<sup>*</sup>)-2-(4-bromophenyl)-1-methoxy-2-phenylcyclopentane
    —— 4-sec-butoxy-3-chloro-benzonitrile 1035217-73-2 C11H12ClNO
    4-sec-butoxy-3-chloro-benzonitrile
    —— —— 16605-68-8 C23H31NO2
    —— 2-(2,4-dichlorophenyl)-2H,3H,3aH,4H,5H,6H-cyclopenta[c]pyrazol-3-one 1304083-48-4 C12H10Cl2N2O
    2-(2,4-dichlorophenyl)-2H,3H,3aH,4H,5H,6H-cyclopenta[c]pyrazol-3-one
    —— N-(3,4-Dichlor-benzyloxy)-urethan 15308-35-7 C10H11Cl2NO3
    N-(3,4-Dichlor-benzyloxy)-urethan
    —— N-Methyl-(3-hydroxycyclohex-4-ene)carboxamide 135715-24-1 C8H13NO2
    N-Methyl-(3-hydroxycyclohex-4-ene)carboxamide
    —— 5-[2-(4-bromophenyl)-2-oxoethyl]-3-(4-chlorophenyl)-2-thioxo-1,3-thiazolidin-4-one 1075256-87-9 C17H11BrClNO2S2
    5-[2-(4-bromophenyl)-2-oxoethyl]-3-(4-chlorophenyl)-2-thioxo-1,3-thiazolidin-4-one
    —— 5-methyl-6-phenylimidazo[1,2-a]pyrimidin-7-ol 1116116-90-5 C13H11N3O
    5-methyl-6-phenylimidazo[1,2-a]pyrimidin-7-ol
    —— 3,16-dihydroxyolean-12-en-23,28-dioic acid 28-methyl ester 1312022-98-2 C31H48O6
    3,16-dihydroxyolean-12-en-23,28-dioic acid 28-methyl ester
    —— 1,4-Bis(4-tolylsulfonyl)-1,3-cyclopentadien 101054-57-3 C19H18O4S2
    1,4-Bis(4-tolylsulfonyl)-1,3-cyclopentadien
    —— N-(4-aminophenyl)-1-pentanoylpyrrolidine-2-carboxamide 1334672-37-5 C17H25N3O2
    N-(4-aminophenyl)-1-pentanoylpyrrolidine-2-carboxamide
    —— Acetic acid (2R,3R,6R)-2-acetoxymethyl-6-(pyridin-2-ylsulfanyl)-3,6-dihydro-2H-pyran-3-yl ester 154703-87-4 C15H17NO5S
    Acetic acid (2R,3R,6R)-2-acetoxymethyl-6-(pyridin-2-ylsulfanyl)-3,6-dihydro-2H-pyran-3-yl ester
    —— —— 1325449-27-1 C20H24O3P2S
    —— 2-{5-[(2-thiophen-2-ylphenyl)carbonyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}quinoline 1293280-75-7 C26H23N3OS
    2-{5-[(2-thiophen-2-ylphenyl)carbonyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}quinoline
    —— 6-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid 3-methoxybenzylamide 1296200-20-8 C21H18N4O2
    6-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid 3-methoxybenzylamide
    —— 2-(3-{[((S)-1-dimethylaminomethyl-3,3-dimethyl-butyl)-(2'-methyl-biphenyl-2-ylmethyl)-amino]-methyl}-benzyl)-1,1-dioxo-1λ6-isothiazolidine-3-carboxylic acid ((1S,2S,3S,5R)-2,6,6-trimethyl-bicyclo[3.1.1]hept-3-yl)-amide trifluoroacetate salt 1308661-63-3 C2HF3O2*C45H64N4O3S
    2-(3-{[((S)-1-dimethylaminomethyl-3,3-dimethyl-butyl)-(2'-methyl-biphenyl-2-ylmethyl)-amino]-methyl}-benzyl)-1,1-dioxo-1λ6-isothiazolidine-3-carboxylic acid ((1S,2S,3S,5R)-2,6,6-trimethyl-bicyclo[3.1.1]hept-3-yl)-amide trifluoroacetate salt
    —— 9-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-N-(2-(4-(2,3-dimethylphenyl)piperazin-1-yl)ethyl)-8-ethyl-9H-purine-6-amine 1307784-28-6 C29H35N7O2
    9-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-N-(2-(4-(2,3-dimethylphenyl)piperazin-1-yl)ethyl)-8-ethyl-9H-purine-6-amine
    —— 2-((2-(piperidin-1-yl)-6-(2,2,2-trifluoroethoxy)pyridin-3-yl)methyl)isoindoline-1,3-dione 1373863-68-3 C21H20F3N3O3
    2-((2-(piperidin-1-yl)-6-(2,2,2-trifluoroethoxy)pyridin-3-yl)methyl)isoindoline-1,3-dione
    —— (2R)-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-2-(phenylmethoxycarbonylamino)butanoic acid 1039361-79-9 C22H32N2O6
    (2R)-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-2-(phenylmethoxycarbonylamino)butanoic acid
    —— 3,4-dichloro-N-[2-[3-[3-(4-methoxyphenyl)pyrrolidin-1-yl]pyrrolidin-1-yl]-2-oxoethyl]benzamide 1027773-50-7 C24H27Cl2N3O3
    3,4-dichloro-N-[2-[3-[3-(4-methoxyphenyl)pyrrolidin-1-yl]pyrrolidin-1-yl]-2-oxoethyl]benzamide
    —— (2R,3R)-3-[5-bromo-2-[4-[[4-(2-hydroxyethylamino)-5-methylpyrimidin-2-yl]amino]anilino]pyrimidin-4-yl]oxybutan-2-ol 1034358-58-1 C21H26BrN7O3
    (2R,3R)-3-[5-bromo-2-[4-[[4-(2-hydroxyethylamino)-5-methylpyrimidin-2-yl]amino]anilino]pyrimidin-4-yl]oxybutan-2-ol
    —— —— 1333324-39-2 C42H56N4O14
    —— N,N'-hexane-1,6-diylbis[2-(2-hydroxynaphth-1-yl)pyrrolidine-1-carboxamide] 1620286-17-0 C36H42N4O4
    N,N'-hexane-1,6-diylbis[2-(2-hydroxynaphth-1-yl)pyrrolidine-1-carboxamide]
    —— methyl 4,6-O-benzylidene-3-O-benzyl-2-O-(methoxycarbonylmethyl)-α-D-mannopyranoside 136632-92-3 C24H28O8
    methyl 4,6-O-benzylidene-3-O-benzyl-2-O-(methoxycarbonylmethyl)-α-D-mannopyranoside
    —— (R)-2-hydroxy-4-methyl-pentanoic acid [(S)-1-[(6-amino-pyridin-3-ylmethyl)-carbamoyl]-2-(3,4-difluoro-phenyl)-ethyl]-amide 1300007-46-8 C21H26F2N4O3
    (R)-2-hydroxy-4-methyl-pentanoic acid [(S)-1-[(6-amino-pyridin-3-ylmethyl)-carbamoyl]-2-(3,4-difluoro-phenyl)-ethyl]-amide
    —— 4-(2-hydroxy-3-(1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-ylamino)propoxy)benzene-1,2-diol 1042162-91-3 C26H28N4O4S
    4-(2-hydroxy-3-(1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-ylamino)propoxy)benzene-1,2-diol
    —— 3-[6-(2-methoxyethyl)-3-pyridinyl]-2,6-dimethyl-8-(4-pyridinyl)-imidazo[1,2-b]pyridazine 1298030-49-5 C21H21N5O
    3-[6-(2-methoxyethyl)-3-pyridinyl]-2,6-dimethyl-8-(4-pyridinyl)-imidazo[1,2-b]pyridazine
    —— 3-(4,6-dimethylpyrimidin-2-yl)-8-{[4-methoxy-2-(2H-1,2,3-triazol-2-yl)phenyl]carbonyl}-(1S,6R)-3,8-diazabicyclo[4.2.0]octane 1293939-26-0 C22H25N7O2
    3-(4,6-dimethylpyrimidin-2-yl)-8-{[4-methoxy-2-(2H-1,2,3-triazol-2-yl)phenyl]carbonyl}-(1S,6R)-3,8-diazabicyclo[4.2.0]octane
    —— (E)-1-(4-nitrophenyl)-2-(4-chlorophenylmethylsulfonyl)-3-(2-methoxyphenyl)prop-2-en-1-one 1035201-21-8 C23H18ClNO6S
    (E)-1-(4-nitrophenyl)-2-(4-chlorophenylmethylsulfonyl)-3-(2-methoxyphenyl)prop-2-en-1-one
    —— Ertugliflozin metabolite M1a 1298086-33-5 C22H25ClO8
    Ertugliflozin metabolite M1a
    —— 2-(4-bromophenyl)-N-ethyl-7-(trifluoromethyl)quinazolin-4-amine 1278575-17-9 C17H13BrF3N3
    2-(4-bromophenyl)-N-ethyl-7-(trifluoromethyl)quinazolin-4-amine
    —— (1R,4R)-2,2-dimethyl-4-(5-phenylethynylpyrimidin-2-ylamino)cyclohexanol 1295502-01-0 C20H23N3O
    (1R,4R)-2,2-dimethyl-4-(5-phenylethynylpyrimidin-2-ylamino)cyclohexanol
    —— N-{4-[4-(3-pyridin-4-yl-propionyl)-piperazine-1-sulfonyl]-phenyl}-acrylamide 1306721-06-1 C21H24N4O4S
    N-{4-[4-(3-pyridin-4-yl-propionyl)-piperazine-1-sulfonyl]-phenyl}-acrylamide
    —— 3-Amino-4-[4-(2-amino-4-carbamimidoylphenoxy)butoxy]benzenecarboximidamide;hydrochloride 125880-60-6 C18H24N6O2*4ClH
    3-Amino-4-[4-(2-amino-4-carbamimidoylphenoxy)butoxy]benzenecarboximidamide;hydrochloride
    —— 3,5,5-trimethyl-1-(4-(1-oxo-2-propyl-1,2,3,4-tetrahydroisoquinolin-6-yl)benzyl)imidazolidine-2,4-dione 1295301-77-7 C25H29N3O3
    3,5,5-trimethyl-1-(4-(1-oxo-2-propyl-1,2,3,4-tetrahydroisoquinolin-6-yl)benzyl)imidazolidine-2,4-dione
    —— N-(1-((3-fluoro-4-methylphenyl)sulfonyl)-1H-pyrazol-4-yl)picolinamide 1296784-20-7 C16H13FN4O3S
    N-(1-((3-fluoro-4-methylphenyl)sulfonyl)-1H-pyrazol-4-yl)picolinamide
    —— [(12R,15R,32S,33R)-4,5,6,20,21,22,25,26,27,38,39,45,46-tridecamethoxy-9,17,30,35,42-pentaoxo-2,10,13,16,31,34,41-heptaoxanonacyclo[34.9.3.03,8.012,33.015,32.018,23.024,29.040,48.043,47]octatetraconta-1(45),3,5,7,18,20,22,24,26,28,36,38,40(48),43,46-pentadecaen-14-yl] acetate 126594-61-4 C56H54O27
    [(12R,15R,32S,33R)-4,5,6,20,21,22,25,26,27,38,39,45,46-tridecamethoxy-9,17,30,35,42-pentaoxo-2,10,13,16,31,34,41-heptaoxanonacyclo[34.9.3.03,8.012,33.015,32.018,23.024,29.040,48.043,47]octatetraconta-1(45),3,5,7,18,20,22,24,26,28,36,38,40(48),43,46-pentadecaen-14-yl] acetate
    —— methyl 1,3,4,5-tetra-O-benzoyl-D-ido-2-heptulopyranoside 115250-23-2 C36H32O11
    methyl 1,3,4,5-tetra-O-benzoyl-D-ido-2-heptulopyranoside
    —— 3-(5-(phenylethynyl)pyridin-2-ylmethyl)oxazolidin-2-one 1295501-84-6 C17H14N2O2
    3-(5-(phenylethynyl)pyridin-2-ylmethyl)oxazolidin-2-one
    —— N-(3-methoxybenzyl)-6-(pyridin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide 1296200-88-8 C21H18N4O2
    N-(3-methoxybenzyl)-6-(pyridin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
    —— 5-[4-(Cyclopropylmethyl)-10-morpholin-4-yl-1,4,8,11-tetrazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraen-12-yl]pyrimidin-2-amine 1280202-25-6 C21H26N8O
    5-[4-(Cyclopropylmethyl)-10-morpholin-4-yl-1,4,8,11-tetrazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraen-12-yl]pyrimidin-2-amine
    —— (5S,6R,7R,8S)-5-[3-(4-ethoxy-benzyl)-4-methyl-phenyl]-4-oxa-spiro[2.5]octane-6,7,8-triol 1290629-71-8 C23H28O5
    (5S,6R,7R,8S)-5-[3-(4-ethoxy-benzyl)-4-methyl-phenyl]-4-oxa-spiro[2.5]octane-6,7,8-triol
    —— 4-Amino-2-(1-phenylethyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one 1305263-53-9 C17H15N5O
    4-Amino-2-(1-phenylethyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one