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CAS号名称物化性质分子式分子量
2113650-04-5(R)-2-((2-((3-氰基苄基)氧基)-4-((3-(2,3-二氢苯并[b][1,4]二氧杂环己烯-6-基)-2-甲基苄基) 氧基)-5-甲基苄基)氨基)-3-羟基丙酸盐酸盐
(2-((3-Cyanobenzyl)oxy)-4-((3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-methylbenzyl)oxy)-5-methylbenzyl)-D-serine hydrochloride
C35H35ClN2O7631.11
1323077-89-9(R)-1-(3-甲基异恶唑-4-羰基)-10a-(6-甲基吡啶-3-基)-2,3,10,10a-四氢咪唑并[1,2-a]吡咯并[1,2-d]吡嗪-5(1H)-酮
(R)-1-(3-Methylisoxazole-4-carbonyl)-10a-(6-methylpyridin-3-yl)-2,3,10,10a-tetrahydroimidazo[1,2-a]pyrrolo[1,2-d]pyrazin-5(1H)-one
C20H19N5O3377.40
220556-74-1(R)-(+)-Linoleyl-1'-Hydroxy-2'-Propylamide
C21H39NO2337.5
98791-67-4(R)-(+)-Bay-K-8644
C16H15F3N2O4356.30
1217757-71-5(R)-(+)-5'-Hydroxyphenyl Carvedilol
C24H26N2O5422.47
2227246-92-4(Fmoc-氨基)-PEG12-C2-羧酸NHS酯
2,5-Dioxopyrrolidin-1-yl 1-(9H-fluoren-9-yl)-3-oxo-2,7,10,13,16,19,22,25,28,31,34,37,40-tridecaoxa-4-azatritetracontan-43-oate
C46H68N2O18937.03
137089-36-2(E)-N-[2-(2-cyclohexylethylsulfanyl)ethyl]dec-2-enamide
2-(E-2-decenoylamino)ethyl 2-(cyclohexylethyl) sulfide
C20H37NOS339.58
1375060-02-8(E)-N'-(4-(二乙基氨基)-2-羟基亚苄基)烟酰肼
(E)-N'-(4-(Diethylamino)-2-hydroxybenzylidene)nicotinohydrazide
密度:1.16±0.1 g/cm3(Predicted)
C17H20N4O2312.37
933030-60-5(E)-C-HDMAPP (ammonium salt)
(E)-C-HDMAPP (ammonium salt) ((​E)-5-hydroxy-4-methylpent-3-enyl pyrophosphate)
C6H14O7P23NH4311.2
125720-84-5(E)-Alprenoxime
C15H22N2O2262.35
959841-49-7(E)-AKTIV
(E)-Akt inhibitor-IV
C31H27IN4S614.54
1255639-43-0(E)-5-(4-羟基苯基)-2-((E)-3-(4-羟基苯基)丙烯酰基)-3-氧代-N-苯基戊-4-烯酰胺
(E)-5-(4-hydroxyphenyl)-2-((E)-3-(4-hydroxyphenyl)acryloyl)-3-oxo-N-phenylpent-4-enamide
C26H21NO5427.5
58436-29-6(E)-3-甲氧基-5-(4-甲氧基苯乙烯基)苯酚
(E)-3-Methoxy-5-(4-methoxystyryl)phenol
C16H16O3256.3
1198078-60-2(E)-3-(2-Bromo-3,4-dihydroxyphenyl)-N-(3,4,5-trihydroxybenzyl)prop-2-enethioamide
C16H14BrNO5S412.26
1245792-51-1(E)-2-亚苄基-3-(环己基氨基)-2,3-二氢-1H-茚-1-酮
(E)-2-Benzylidene-3-(cyclohexylamino)-2,3-dihydro-1H-inden-1-one
C22H23NO317.42
22644-96-8(E)-2-Hexadecenal
(E)-2-Hexadecenal (trans-2-Hexadecenal)
C16H30O238.4
133550-22-8(E)-2-benzoyl-3-(3,4-dihydroxyphenyl)prop-2-enenitrile
EGFR-IN-16
C16H11NO3265.26
51589-67-4(E)-1-(5-羟基-2,2-二甲基-2H-苯并吡喃-6-基)-3-(4-甲氧基苯基)丙-2-烯-1-酮
4-Methoxylonchocarpin
密度:1.193±0.06 g/cm3(Predicted)
沸点:535.2±50.0 °C(Predicted)
C21H20O4336.38
134271-74-2(E)-1-(2-aminophenyl)-3-(3-nitrophenyl)prop-2-en-1-one
CDC25B-IN-2
C15H12N2O3268.27
1217759-04-0(9H-芴-9-基)甲氧基]羰基D-2-氨基甲酰基
Fmoc-D-2-carbamoylphenylalanine
868774-16-7(6S)-N-苄基-6-(4-羟基苄基-6-(4-萘-1-基甲基-6-(4-二氧代六氢-2H-吡嗪并[1,2-a]嘧啶-1(6H)-甲酰胺
(6S)-N-Benzyl-6-(4-hydroxybenzyl)-8-(naphthalen-1-ylmethyl)-4,7-dioxohexahydro-2H-pyrazino[1,2-a]pyrimidine-1(6H)-carboxamide
密度:1.37±0.1 g/cm3(Predicted)
沸点:895.6±65.0 °C(Predicted)
C33H32N4O4548.63
2828432-48-8(6R,9S,12S,15S,17aS,23R,26S,29S,32S,34aS)-12,29-双(3-氨基丙基)-6,23-二苄基-9,26-二异丁基-15,32-二异丙基二十四氢二吡咯烷并[1,2-a:1',2'-p][1,4,7,10,13,16,19,22,25,28]十氮杂环三十烷-5,8,11,14,17,22,25,28,31,34-十酮三氟乙酸盐
(6R,9S,12S,15S,17aS,23R,26S,29S,32S,34aS)-12,29-Bis(3-aminopropyl)-6,23-dibenzyl-9,26-diisobutyl-15,32-diisopropyltetracosahydrodipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19,22,25,28]decaazacyclotriacontine-5,8,11,14,17,22,25,28,31,34-decaone trifluoroacetat
C62H93F3N12O121255.47
1361390-56-8(5S,8S,E)-2,5-二氧代吡咯烷-1-基 11-(2-氨基-2-氧代乙基)-5,8-二甲基-3,6,9,12-四氧代-1-苯基-2-氧杂-4,7,10,11-四氮杂pentadec-13-烯-15-酸酯
(5S,8S,E)-2,5-Dioxopyrrolidin-1-yl 11-(2-amino-2-oxoethyl)-5,8-dimethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadec-13-en-15-oate
C24H28N6O10560.51
210344-96-0(5S,8S,11S,14S)-11-((S)-仲丁基)-14-(2-氟乙酰基)-5-异丙基-8-(3-甲氧基-3-氧代丙基)-3,6,9,12-四氧代-1-苯基-2-氧杂-4,7,10,13-四氮杂十六烷-16-酸甲酯
Methyl (5S,8S,11S,14S)-11-((S)-sec-butyl)-14-(2-fluoroacetyl)-5-isopropyl-8-(3-methoxy-3-oxopropyl)-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazahexadecan-16-oate
C31H45FN4O10652.71
173388-20-0(5S)-5-[(2R)-2-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]propyl]-3-methylideneoxolan-2-one
TEI-9647
C27H38O4426.59
180916-16-9(5R,6S)-6-苯基-5-(4-(2-(吡咯烷-1-基)乙氧基)苯基)-5,6,7,8-四氢萘-2-醇
(5R,6S)-6-Phenyl-5-(4-(2-(pyrrolidin-1-yl)ethoxy)phenyl)-5,6,7,8-tetrahydronaphthalen-2-ol
密度:1.150±0.06 g/cm3(Predicted)
熔点:110-113 °C
沸点:572.4±50.0 °C(Predicted)
C28H31NO2413.55
189013-61-4(5R)-BW-4030W92
C11H9Cl2FN4287.12
593273-05-3(5E)-1-(3-chloro-4-methylphenyl)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
DCH36_06
C18H13ClN2O3S372.83
349536-41-0(5-氯-3-(4-(甲基磺酰基)苯基)-[2,3'-联吡啶]-6'-基)甲醇(依托考昔杂质)
6′-Desmethyl-6′-methylhydroxy Etoricoxib
870603-16-0(5-(2-(5-氯-2-甲基苯基)-1-羟基-3-氧代异吲哚啉-1-基)-1H-苯并[d]咪唑-2-基)氨基甲酸甲酯
Methyl (5-(2-(5-chloro-2-methylphenyl)-1-hydroxy-3-oxoisoindolin-1-yl)-1H-benzo[d]imidazol-2-yl)carbamate
C24H19ClN4O4462.89
1237168-58-9(5-((2-((4-氟-3-甲氧基-5-甲基苯基)氨基)-5-甲基嘧啶-4-基)氨基)-2-氧代苯并[d]恶唑-3(2H)-基)甲基磷酸酯
(5-((2-((4-Fluoro-3-methoxy-5-methylphenyl)amino)-5-methylpyrimidin-4-yl)amino)-2-oxobenzo[d]oxazol-3(2H)-yl)methyl dihydrogen phosphate
密度:1.564±0.06 g/cm3(Predicted)
沸点:761.3±70.0 °C(Predicted)
C21H21FN5O7P505.39
357336-19-7(4S)-布瓦西坦
(4S)-Brivaracetam
C11H20N2O2212.29
1897428-40-8(4S)-2,2,4-Trimethylpyrrolidine Hydrochloride
C7H15N • HCl113.20
2828432-43-3(4R,7S,10S,13R,16S,19R)-13-((1H-吲哚-3-基)甲基)-N-((2S,3R)-1-氨基-3-羟基-1-氧代丁烷- 2-基)-19-((R)-2-氨基-3-苯基丙酰胺基)-10-(3-氨基丙基)-16-(4-羟基苄基)-7-((R)-1-羟乙基)-3,3-二甲基-6,9,12,15,18-五氧代-1,1,2-二硫杂-5,8,11,14,17-五氮杂环二十烷-4-羧酰胺三氟乙酸盐
CTOP trifluoroacetate
C52H68F3N11O13S21176.29
222318-55-0(4E)-SUN9221
C25H31FN4O3454.54
511514-03-7(4-phenyl-quinazolin-2-yl)-(4,6,6-trimethyl-1,6-dihydro-pyrimidin-2-yl)-amine
0990CL
C21H21N5343.42
1016543-77-3(4-(2-aminothiazol-4-yl)-2-(1h-1,2,4-triazol-1-yl)phenyl)(3,4,5-trimethoxyphenyl)methanone
C21H19N5O4S437.47
53495-21-9(3β,20E)-24-Norchola-5,20(22)-diene-3,23-diol
C23H36O2344.53
65454-13-9(3S,6R)-Lateritin
C15H19NO3261.31
1428118-38-0(3S,5S)-Atorvastatin sodium salt
C33H34FN2O5 • Na580.6
1801765-04-7(3S,4S)-8-(6-氨基-5-((2-氨基-3-氯吡啶基-4-基)硫代)吡嗪-2-基)-3-甲基-2-氧杂-8-氮杂螺[4.5]癸-4-胺
(3S,4S)-8-(6-Amino-5-((2-amino-3-chloropyridin-4-yl)sulfanyl)pyrazin-2-yl)-3-methyl-2-oxa-8-azaspiro( 4.5)decan-4-amine
C18H24ClN7OS421.950
919514-01-5(3S)-3-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)oxy-N-methyl-3-thiophen-2-ylpropan-1-amine
Duloxetine-d7
C18H12D7NOS304.46
60761-51-5(3R)-hydroxy Quinidine
(3R)-hydroxy Quinidine (3-epi-hydroxy Quinidine)
C20H24N2O3340.4
230961-21-4(3R)-3-[[(2S)-1-[[(1S)-2-Methoxy-1-phenylethyl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamoyl]-6-(3-methyl-4-phenylphenyl)hexanoic acid
UK-370106
C35H44N2O5572.73
1346600-05-2(3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-(trideuteriomethyl)-2,3,4,5,7,7a-hexahydroindol-6-one
Mesembrine-d3
C17H20D3NO3292.39
2218463-36-4(35-羟基-3,6,9,12,15,18,21,24,27,30,33-十一氧杂三十五烷基)氨基甲酸叔丁酯
tert-Butyl (35-hydroxy-3,6,9,12,15,18,21,24,27,30,33-undecaoxapentatriacontyl)carbamate
C29H59NO14645.78
900314-03-6(3-Methyl-4-(m-tolyl)piperazin-1-yl)(7-methylthieno[2,3-b]quinolin-2-yl)methanone
C25H25N3OS415.55
528893-52-9(2Z)-3-[5-(2-Amino-5-chlorophenyl)-1H-1,2,4-triazol-1-yl]-2-propenoic acid ethyl ester
PKF050-638 
C13H13ClN4O2292.72
1378391-45-7(2S,4S)-2-[5-[1,11-二氢-2-[(2S,5S)-1-[(2S)-2-[(甲氧羰基)氨基]-3-甲基-1-氧代丁基]-5-甲基-2-吡咯烷基][2]苯并吡喃并[4',3':6,7]萘并[1,2-D]咪唑-9-基]-1H-咪唑-2-基]-4-(甲氧基甲基)-1-吡咯烷羧酸叔丁酯
(2S,4S)-tert-Butyl 2-(5-(2-((2S,5S)-1-((S)-2-((methoxycarbonyl)amino)-3-methylbutanoyl)-5-methylpyrrolidin-2-yl)-1,11-dihydroisochromeno[4',3':6,7]naphtho[1,2-d]imidazol-9-yl)-1H-imidazol-2-yl)-4-(methoxymethyl)pyrrolidine-1-carboxylate
C44H53N7O7791.93
7196-71-6(2S,3R,4S,5S,6R)-3,4,5-三羟基-6-(羟甲基)四氢-2H-吡喃-2-基 3-(4-羟基-3-甲氧基苯基)丙烯酸酯
Ferulic acid acyl-β-D-glucoside
C16H20O9356.32
11603页,第11445
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