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中文名称 英文名称 CAS号 化学式 结构式图片
—— Ruxolitinib metabolite M18 1315607-85-2 C17H18N6O
Ruxolitinib metabolite M18
—— 5-(2,6-dimethyl-pyran-4-ylidene)-cyclopenta-1,3-diene-1,2-dicarbonitrile 18780-87-5 C14H10N2O
5-(2,6-dimethyl-pyran-4-ylidene)-cyclopenta-1,3-diene-1,2-dicarbonitrile
—— N-((2S,3R,4R,5S,6R)-4,5-bis(benzyloxy)-2-((tert-butyldimethylsilyl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)-2,2,2-trichloroacetamide 1085377-63-4 C28H38Cl3NO6Si
N-((2S,3R,4R,5S,6R)-4,5-bis(benzyloxy)-2-((tert-butyldimethylsilyl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)-2,2,2-trichloroacetamide
—— 6''-dihydro-12S,13R-epoxy-3,5-isopropylidene-6''-O-(tert-butyldiphenylsilyl)niddanolide 137787-94-1 C39H54O8Si
6''-dihydro-12S,13R-epoxy-3,5-isopropylidene-6''-O-(tert-butyldiphenylsilyl)niddanolide
—— [(2-Bromo-acetyl)-naphthalen-1-yl-amino]-acetic acid methyl ester 19889-55-5 C15H14BrNO3
[(2-Bromo-acetyl)-naphthalen-1-yl-amino]-acetic acid methyl ester
—— (-)-(R)-N-isopropylidene-α-aminophenylacetamide 145614-17-1 C11H14N2O
(-)-(R)-N-isopropylidene-α-aminophenylacetamide
—— 3,3'-(1,3-phenylenebis(methylene))bis(2-thioxothiazolidin-4-one) 1384879-42-8 C14H12N2O2S4
3,3'-(1,3-phenylenebis(methylene))bis(2-thioxothiazolidin-4-one)
—— 1-[(1R,2S,5S,3R,4R)-2,3-dihydroxy-4-(hydroxymethyl)bicyclo[3.1.0]hex-1-yl]-1,3-dihydropyrimidine-2,4-dione 1069040-57-8 C11H14N2O5
1-[(1R,2S,5S,3R,4R)-2,3-dihydroxy-4-(hydroxymethyl)bicyclo[3.1.0]hex-1-yl]-1,3-dihydropyrimidine-2,4-dione
—— 1,3:2,5-Dianhydro-D-glucitol 106248-70-8 C6H10O4
1,3:2,5-Dianhydro-D-glucitol
—— N-(2-[bis(carboxymethyl)amino]-3-{4-[(dodecylcarbamothioyl)amino]phenyl}propyl)-N-{2-[bis(carboxymethyl)amino]ethyl}glycine 1263049-49-5 C34H55N5O10S
N-(2-[bis(carboxymethyl)amino]-3-{4-[(dodecylcarbamothioyl)amino]phenyl}propyl)-N-{2-[bis(carboxymethyl)amino]ethyl}glycine
—— 3-methyl-5-pentyl-1,2-dioxolan-3-ol 1037807-18-3 C9H18O3
3-methyl-5-pentyl-1,2-dioxolan-3-ol
—— 3-bromopropyl 4-amino-5-bromo-2-ethoxybenzoate 1388193-82-5 C12H15Br2NO3
3-bromopropyl 4-amino-5-bromo-2-ethoxybenzoate
—— tert-butyl 1-phenyl-2,5,8,11,14,17,20-heptaoxadocosan-22-oate 185990-09-4 C25H42O9
tert-butyl 1-phenyl-2,5,8,11,14,17,20-heptaoxadocosan-22-oate
—— 2-bromo-5-[N-tert-butoxycarbonyl-(4-cyanophenyl)amino]benzyl acetate 1213790-32-9 C21H21BrN2O4
2-bromo-5-[N-tert-butoxycarbonyl-(4-cyanophenyl)amino]benzyl acetate
—— andrographolide-14-butanoate 1201658-82-3 C24H36O6
andrographolide-14-butanoate
—— (3S,5S)-Methyl 5-methylpiperidine-3-carboxylate hydrochloride 1638767-06-2 C8H16ClNO2
(3S,5S)-Methyl 5-methylpiperidine-3-carboxylate hydrochloride
—— 4,6-Bis(trifluoromethyl)-2-[4-(trifluoromethylsulfonyl)phenyl]pyrazolo[3,4-d]pyrimidin-3-amine 1447808-32-3 C14H6F9N5O2S
4,6-Bis(trifluoromethyl)-2-[4-(trifluoromethylsulfonyl)phenyl]pyrazolo[3,4-d]pyrimidin-3-amine
—— 4-(4-cyanophenyl)-2,5-dioxo-N-[(5-oxopyrrolidin-2-yl)methyl]-1-[3-(trifluoromethyl)phenyl]-6,7-dihydro-4H-cyclopenta[d]pyrimidine-3-carboxamide 1621270-53-8 C27H22F3N5O4
4-(4-cyanophenyl)-2,5-dioxo-N-[(5-oxopyrrolidin-2-yl)methyl]-1-[3-(trifluoromethyl)phenyl]-6,7-dihydro-4H-cyclopenta[d]pyrimidine-3-carboxamide
—— 4-(4-cyanophenyl)-1-[3-(difluoromethyl)phenyl]-N-(2-methoxyethyl)-2,5-dioxo-6,7-dihydro-4H-cyclopenta[d]pyrimidine-3-carboxamide 1621272-65-8 C25H22F2N4O4
4-(4-cyanophenyl)-1-[3-(difluoromethyl)phenyl]-N-(2-methoxyethyl)-2,5-dioxo-6,7-dihydro-4H-cyclopenta[d]pyrimidine-3-carboxamide
—— ((2R,3S,6S)-3-(2-methylallyloxy)-6-phenyl-3,6-dihydro-2H-pyran-2-yl)methanol 1233959-67-5 C16H20O3
((2R,3S,6S)-3-(2-methylallyloxy)-6-phenyl-3,6-dihydro-2H-pyran-2-yl)methanol
—— 4-(4-cyanophenyl)-2,5-dioxo-N-(oxolan-3-ylmethyl)-1-[3-(trifluoromethyl)phenyl]-6,7-dihydro-4H-cyclopenta[d]pyrimidine-3-carboxamide 1621271-69-9 C27H23F3N4O4
4-(4-cyanophenyl)-2,5-dioxo-N-(oxolan-3-ylmethyl)-1-[3-(trifluoromethyl)phenyl]-6,7-dihydro-4H-cyclopenta[d]pyrimidine-3-carboxamide
—— ethyl 2-[(1R,2R,3R,5S)-3-acetyloxy-2-[(E,3S)-3-acetyloxyoct-1-enyl]-5-[tert-butyl(dimethyl)silyl]oxycyclopentyl]acetate 120417-67-6 C27H48O7Si
ethyl 2-[(1R,2R,3R,5S)-3-acetyloxy-2-[(E,3S)-3-acetyloxyoct-1-enyl]-5-[tert-butyl(dimethyl)silyl]oxycyclopentyl]acetate
—— 4-amino-1-((2R,3R,4R,5R)-4-((tert-butyldimethylsilyl)oxy)-5-(((tert-butyldiphenylsilyl)oxy)methyl)-3-fluoro-5-(3-methylbut-1-en-1-yl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one 1445396-41-7 C36H52FN3O4Si2
4-amino-1-((2R,3R,4R,5R)-4-((tert-butyldimethylsilyl)oxy)-5-(((tert-butyldiphenylsilyl)oxy)methyl)-3-fluoro-5-(3-methylbut-1-en-1-yl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
—— (1R,2R,7S,8aR)-1,2-di-tert-butoxyoctahydroindolizin-7-yl [10-[[5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoyl]amino]decyl]carbamate 1638743-09-5 C37H67N5O6S
(1R,2R,7S,8aR)-1,2-di-tert-butoxyoctahydroindolizin-7-yl [10-[[5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoyl]amino]decyl]carbamate
—— (1S,3'R,4'S,5'R,6'R)-5'-hydroxy-6'-(hydroxymethyl)-3',5,7-tris(methoxymethoxy)-3',4',5',6'-tetrahydro-3H-spiro[isobenzofuran-1,2'-pyran]-4'-yl (2E,4E)-hexa-2,4-dienoate 1392098-14-4 C25H34O12
(1S,3'R,4'S,5'R,6'R)-5'-hydroxy-6'-(hydroxymethyl)-3',5,7-tris(methoxymethoxy)-3',4',5',6'-tetrahydro-3H-spiro[isobenzofuran-1,2'-pyran]-4'-yl (2E,4E)-hexa-2,4-dienoate
—— N-(6-(3-(dimethylamino)prop-1-ynyl)-4-hydroxy-7-methoxy-8-methyl-2-oxo-2H-chromen-3-yl)-2,2-dimethylchroman-6-carboxamide 1620841-66-8 C28H30N2O6
N-(6-(3-(dimethylamino)prop-1-ynyl)-4-hydroxy-7-methoxy-8-methyl-2-oxo-2H-chromen-3-yl)-2,2-dimethylchroman-6-carboxamide
—— 2-(6-((3-(3-(2-azidoethoxy)phenyl)-4,5-dihydroisoxazol-5-yl)methoxy)-3-oxo-3H-xanthen-9-yl)benzoic acid 1621132-91-9 C32H24N4O7
2-(6-((3-(3-(2-azidoethoxy)phenyl)-4,5-dihydroisoxazol-5-yl)methoxy)-3-oxo-3H-xanthen-9-yl)benzoic acid
—— (2R,3R,4R,5R)-3-(benzyloxy)-2-((benzyloxy)methyl)-4-fluoro-5-(3-(4-methoxybenzyl)-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-carbaldehyde 1445386-52-6 C32H31FN2O7
(2R,3R,4R,5R)-3-(benzyloxy)-2-((benzyloxy)methyl)-4-fluoro-5-(3-(4-methoxybenzyl)-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-carbaldehyde
—— (3aR,6S,6aS)-6-[5-[methoxy(morpholin-4-yl)phosphanyl]oxypentyl]-3-(6-methoxyoxan-2-yl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-one 122250-26-4 C21H38N3O6PS
(3aR,6S,6aS)-6-[5-[methoxy(morpholin-4-yl)phosphanyl]oxypentyl]-3-(6-methoxyoxan-2-yl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-one
—— —— 133727-62-5 C25H23N5O3*ClH
—— 3-[2-[6,8-Bis(sulfanyl)octanoylamino]ethyl-dimethylazaniumyl]propane-1-sulfonate 1309852-79-6 C15H32N2O4S3
3-[2-[6,8-Bis(sulfanyl)octanoylamino]ethyl-dimethylazaniumyl]propane-1-sulfonate
—— (1R,3aR,5aS,11aR,11bS,13aR)-13a-Methyl-1-((E)-(1R,4R)-1,4,5-trimethyl-hex-2-enyl)-2,3,3a,5,5a,11a,11b,12,13,13a-decahydro-1H-indeno[5,4-a]anthracene-6,11-dione 194230-73-4 C31H40O2
(1R,3aR,5aS,11aR,11bS,13aR)-13a-Methyl-1-((E)-(1R,4R)-1,4,5-trimethyl-hex-2-enyl)-2,3,3a,5,5a,11a,11b,12,13,13a-decahydro-1H-indeno[5,4-a]anthracene-6,11-dione
—— —— 176747-10-7 C56H105N8O9P
—— 42-O-[2,2,2-trifluoro-1-(4-(2-hydroxyethyl)piperidin-1-yl)ethyl]rapamycin 1192722-11-4 C60H91F3N2O14
42-O-[2,2,2-trifluoro-1-(4-(2-hydroxyethyl)piperidin-1-yl)ethyl]rapamycin
—— 4-(8-Chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-yl)-1-methyl-piperidine-3-carboxylic acid methyl ester 153711-45-6 C22H25ClN2O2
4-(8-Chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-yl)-1-methyl-piperidine-3-carboxylic acid methyl ester
—— 2-(2-Methylphenyl)-4-nitropyridine 1345043-97-1 C12H10N2O2
2-(2-Methylphenyl)-4-nitropyridine
—— trans-1,2-diaminomethylcyclobutane diiodoplatinum(II) 1240256-76-1 C6H14I2N2Pt
trans-1,2-diaminomethylcyclobutane diiodoplatinum(II)
—— (CH3CH2CH2O)4C28H16(NH2)3(NHCOFc) 1252577-77-7 C51H60FeN4O5
(CH3CH2CH2O)4C28H16(NH2)3(NHCOFc)
—— 2-cyano-7-(5-hexyl-10,11-dihydro-5H-dibenzo[b,f]azepin-2-yl)hepta-2,4,6-trienoic acid 1311498-29-9 C28H30N2O2
2-cyano-7-(5-hexyl-10,11-dihydro-5H-dibenzo[b,f]azepin-2-yl)hepta-2,4,6-trienoic acid
—— 1,1-dimethylethyl {(1S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1-[(4-{8-[(1S)-1-hydroxyethyl]imidazo[1,2-a]pyridin-2-yl}phenyl)methyl]ethyl}carbamate 1240137-64-7 C31H32N4O5
1,1-dimethylethyl {(1S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1-[(4-{8-[(1S)-1-hydroxyethyl]imidazo[1,2-a]pyridin-2-yl}phenyl)methyl]ethyl}carbamate
—— N-[(6R)-3-acetoxymethyl-8-oxo-7t-(2-thiophen-2-yl-acetylamino)-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carbonyloxy]-phthalimide 10589-95-4 C24H19N3O8S2
N-[(6R)-3-acetoxymethyl-8-oxo-7t-(2-thiophen-2-yl-acetylamino)-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carbonyloxy]-phthalimide
—— 3-(2-Aminoethylthio)propyl-L-glycero-α-D-manno-heptopyranosid hydrochloride 135284-16-1 C12H25NO7S*ClH
3-(2-Aminoethylthio)propyl-L-glycero-α-D-manno-heptopyranosid hydrochloride
—— N-(1H-indol-3-yl-methylidene)-N'-(7-morpholin-4-yl-2-pyridin-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl)-hydrazine 1232220-80-2 C24H22N8O
N-(1H-indol-3-yl-methylidene)-N'-(7-morpholin-4-yl-2-pyridin-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl)-hydrazine
—— methyl 4-(2-(3-(1-acetylpiperidin-4-yl)-1,2,4-thiadiazol-5-ylamino)-5-phenoxypyridin-3-ylthio)benzoate 1065608-15-2 C28H27N5O4S2
methyl 4-(2-(3-(1-acetylpiperidin-4-yl)-1,2,4-thiadiazol-5-ylamino)-5-phenoxypyridin-3-ylthio)benzoate
—— 6-(methoxymethoxy)hex-1-yn-3-ol 1231753-34-6 C8H14O3
6-(methoxymethoxy)hex-1-yn-3-ol
—— 4-(4-(4-(trifluoromethoxy)phenyl)piperidin-1-yl)benzonitrile 1613627-57-8 C19H17F3N2O
4-(4-(4-(trifluoromethoxy)phenyl)piperidin-1-yl)benzonitrile
—— 4-Amino-1-((2R,3S,4R,5R)-3,4-difluoro-5-trityloxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidin-2-one 127841-13-8 C28H25F2N3O3
4-Amino-1-((2R,3S,4R,5R)-3,4-difluoro-5-trityloxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidin-2-one
—— benzoyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate 143417-82-7 C20H17ClN2O7S
benzoyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate
—— 2-cyclohex-3-en-1-yl-4-(1,3-dichloropropan-2-yloxymethyl)-1,3-dioxolane 139597-33-4 C13H20Cl2O3
2-cyclohex-3-en-1-yl-4-(1,3-dichloropropan-2-yloxymethyl)-1,3-dioxolane
—— (R)-N-[1-(1-naphthyl)ethyl]-3-[3-(trifluoromethyl)phenyl]-1-aminopropane (-)-di-p-toluoyl-D-tartrate 1025064-35-0 C20H18O8*C22H22F3N
(R)-N-[1-(1-naphthyl)ethyl]-3-[3-(trifluoromethyl)phenyl]-1-aminopropane (-)-di-p-toluoyl-D-tartrate