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Search results for: '413605-11-5(DMSO)'
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(5S)-14-(4-chlorophenyl)-5-methyl-6-oxa-11-thia-3,9,14,16-tetraazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1,7,9,12(17),15-pentaen-13-one, Allosteric modulator of mGlu 1 receptor
Synonyms: compound 23hSMILES: C[C@H]1CNc2c(O1)cnc1c2c2ncn(c(=O)c2s1)c1ccc(cc1)ClInChIKey: LFUPTQIEOBBAJE-VIFPVBQESA-NInChI: InChI=1S/C18H13ClN4O2S/c1-9-6-20-14-12(25-9)7-21-17-13(14)15-16(26-17)18(24)23(8-22-15)11-4-2-10(19)3-5-11/h2-5,7-9,20H,6H2,1H3/t9-/m0/s1
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(6R,7R)-1-[(4S,5R)-4-(acetyloxy)-5-benzyl-3-methylidenehexyl]-4,7-dihydroxy-6-[(11-phenoxyundecanoyl)oxy]-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid, Inhibitor of squalene synthase
Synonyms: compound 3fSMILES: CC(=O)O[C@@H]([C@@H](Cc1ccccc1)C)C(=C)CCC12OC(C(=O)O)C(C(O1)([C@@H]([C@H]2O)OC(=O)CCCCCCCCCCOc1ccccc1)C(=O)O)(O)C(=O)OInChIKey: MNIPVWXWSPXERA-IDNZQHFXSA-NInChI: See more
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(6R,7R)-1-[(4S,5R)-4-(acetyloxy)-5-benzyl-3-methylidenehexyl]-4,7-dihydroxy-6-{[(11-phenoxyundecyl)carbamoyl]oxy}-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid, Inhibitor of squalene synthase
Synonyms: compound 4eSMILES: CC(=O)O[C@@H]([C@@H](Cc1ccccc1)C)C(=C)CCC12OC(C(=O)O)C(C(O1)([C@@H]([C@H]2O)OC(=O)NCCCCCCCCCCCOc1ccccc1)C(=O)O)(O)C(=O)OInChIKey: QOLHWXNSCZGWHK-BWBORTOCSA-NInChI: See more
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(6R,7R)-1-[(4S,5R)-4-(acetyloxy)-5-benzyl-3-methylidenehexyl]-4,7-dihydroxy-6-({[(11-phenoxyundecyl)oxy]carbonyl}oxy)-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid, Inhibitor of squalene synthase
Synonyms: compound 5dSMILES: CC(=O)O[C@@H]([C@@H](Cc1ccccc1)C)C(=C)CCC12OC(C(=O)O)C(C(O1)([C@@H]([C@H]2O)OC(=O)OCCCCCCCCCCCOc1ccccc1)C(=O)O)(O)C(=O)OInChIKey: JJAXJXFYWFJTKF-BWBORTOCSA-NInChI: See more
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1-((R)-11-(((R)-1-(3-(Difluoromethyl)-2-fluorophenyl)ethyl)amino)-9-methyl-1,2,3,4,4a,5-hexahydropyrazino[1′,2′:4,5][1,4]oxazino[3,2-g]quinazoline-3-carbonyl)cyclopropane-1-carbonitrile, SOS Ras/Rac guanine nucleotide exchange factor 1
Synonyms: compound 37SMILES: Cc1nc2cc3OC[C@@H]4N(CCN(C(=O)C5(C#N)CC5)C4)c3cc2c(N[C@H](C)c2cccc(C(F)F)c2F)n1InChIKey: KKFFOOWORPUAJB-NVXWUHKLSA-NInChI: See more
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(1S,2S,5R,7R,10R,11S,15R,16S)-5-hydroxy-14-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-16-yl (2S)-2-methylbutanoate, Inhibitor of hydroxymethylglutaryl-CoA reductase
Synonyms: compound 9SMILES: CC[C@@H](C(=O)O[C@H]1C[C@H]2[C@H]([C@H]3[C@@]1(C)C(CC[C@@H]1C[C@@H](O)CC(=O)O1)CC3)CC[C@H]1[C@]2(C)CC[C@H](C1)O)CInChIKey: CFMOEGAYJQXZMT-UQTJVAAQSA-NInChI: See more
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(2R,4aR)-11-Chloro-9-fluoro-10-(2-fluoro-6-hydroxyphenyl)-2,6-dimethyl-3-(prop-2-enoyl)-2,3,4,4a-tetrahydro-1H-pyrazino[1′,2′:4,5]pyrazino[2,3-c]quinolin-5(6H)-one, Inhibitor of KRAS
Synonyms: compound 25SMILES: C=CC(=O)N1C[C@@H]2C(=O)N(C)c3c(N2C[C@H]1C)c1cc(Cl)c(c(c1nc3)F)c1c(O)cccc1FInChIKey: XDVMVEOFPVCHEL-SJKOYZFVSA-NInChI: InChI=1S/C25H21ClF2N4O3/c1-4-19(34)31-11-17-25(35)30(3)16-9-29-23-13(24(16)32(17)10-12(31)2)8-14(26)20(22(23)28)21-15(27)6-5-7-18(21)33/h4-9,12,17,33H,1,10-11H2,2-3H3/t12-,17-/m1/s1
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Trametinib DMSO solvate, Dual specificity mitogen-activated protein kinase kinase 1 inhibitor
Cas Number: 1187431-43-1Formula: C28H29FIN5O5SMolecular weight: 693.53Synonyms: 1187431-43-1|Trametinib DMSO solvate|TRAMETINIB DIMETHYL SULFOXIDE|Trametinib DMSO|GSK1120212B|Mekin...SMILES: CC1=C2C(=C(N(C1=O)C)NC3=C(C=C(C=C3)I)F)C(=O)N(C(=O)N2C4=CC=CC(=C4)NC(=O)C)C5CC5.CS(=O)CInChIKey: OQUFJVRYDFIQBW-UHFFFAOYSA-NInChI: InChI=1S/C26H23FIN5O4.C2H6OS/c1-13-22-21(23(31(3)24(13)35)30-20-10-7-15(28)11-19(20)27)25(36)33(17-8-9-17)26(37)32(22)18-6-4-5-16(12-18)29-14(2)34;1-4(2)3/h4-7,10-12,17,30H,8-9H2,1-3H3,(H,29,34);1-2H3
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1-O-[(1S,2S,4S,7R,9S,10S,12R,15S)-4-acetyloxy-2-benzoyloxy-1,12-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-propanoyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-15-yl] 5-O-tert-butyl (2R,3R)-3-(furan-2-yl)-2-hydroxypentanedioate, Tubulin inhibitor
Formula: C45H56O16Molecular weight: 852.9Synonyms: CHEMBL2107759SMILES: CCC(=O)OC1CC2C(CO2)(C3C1(C(=O)C(C4=C(C(CC(C3OC(=O)C5=CC=CC=C5)(C4(C)C)O)OC(=O)C(C(CC(=O)OC(C)(C)C)C6=CC=CO6)O)C)O)C)OC(=O)CInChIKey: GJQWFXNJAXOCBV-XVGNUGADSA-NInChI: See more
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(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2S,3R,4S,6R)-3-[3-[(7-chloroquinolin-4-yl)amino]propoxy]-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,6,8,10,12,14-heptameth
Synonyms: compound 2SMILES: CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OCCCNc2ccnc3c2ccc(c3)Cl)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)OInChIKey: KZRUOZJPVVJKAE-ZPHCEPPYSA-NInChI: See more
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1,4-dioxadispiro[4.2.5⁸.2⁵]pentadecan-11-ol
Cas Number: 2306278-61-3Formula: C13H22O3Molecular weight: 226.31Synonyms: 2306278-61-3 | 1,4-Dioxadispiro[4.2.5.2]pentadecan-11-ol | PB42267 | D79054 | 1,4-DIOXADISPIRO[4.2.5...SMILES: C1CC2(CCC1O)CCC3(CC2)OCCO3InChIKey: WIBIUFBVTGILTD-UHFFFAOYSA-NInChI: InChI=1S/C13H22O3/c14-11-1-3-12(4-2-11)5-7-13(8-6-12)15-9-10-16-13/h11,14H,1-10H2
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8-Chloro-5,10-dihydro-11H-dibenzo[b,e][1,4]-diazepin-11-one
Cas Number: 50892-62-1Formula: C13H9ClN2OMolecular weight: 244.68Synonyms: H10197 | 8-Chloro-5, 10-dihydro-11H-dibenzo (b, E) (1, 4) diazepin-11-one | 8-Chloro-5,10-dihydrodeb...SMILES: C1=CC=C2C(=C1)C(=O)NC3=C(N2)C=CC(=C3)ClInChIKey: YVWNDABPZGGQFE-UHFFFAOYSA-NInChI: InChI=1S/C13H9ClN2O/c14-8-5-6-11-12(7-8)16-13(17)9-3-1-2-4-10(9)15-11/h1-7,15H,(H,16,17)
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2,2-Dimethyl-1,3-dioxan-5-amine
Cas Number: 40137-24-4 EC Number: ‘832-575-6Formula: C6H13NO2Molecular weight: 131.17Synonyms: C75033 | SY113706 | 2,2-Dimethyl-1,3-dioxan-5-amine (with DMSO) | (2,2-dimethyl-1,3-dioxan-5-yl)amin...SMILES: CC1(OCC(CO1)N)CInChIKey: ADLFBRNPQMLXTQ-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO2/c1-6(2)8-3-5(7)4-9-6/h5H,3-4,7H2,1-2H3
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1,3,5,7,9,11,14-Heptaisobutyltricyclo[7.3.3.15,11]heptasiloxane-endo-3,7,14-triol
Cas Number: 307531-92-6Formula: C28H66O12Si7Molecular weight: 791.41Synonyms: SCHEMBL1860777 | 1,3,5,7,9,11,14-Heptaisobutyltricyclo[7.3.3.15,11]heptasiloxane-endo-3,7,14-triol, ...SMILES: CC(C)C[Si]1(O[Si]2(O[Si](O[Si]3(O[Si](O[Si](O1)(O[Si](O2)(O3)CC(C)C)CC(C)C)(CC(C)C)O)CC(C)C)(CC(C)C)O)CC(C)C)OInChIKey: APIBTMSFBUJAAC-UHFFFAOYSA-NInChI: InChI=1S/C28H66O12Si7/c1-22(2)15-41(29)32-44(18-25(7)8)34-42(30,16-23(3)4)36-46(20-27(11)12)37-43(31,17-24(5)6)35-45(33-41,19-26(9)10)39-47(38-44,40-46)21-28(13)14/h22-31H,15-21H2,1-14H3
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4-{[(9S)-9-hydroxy-2-azatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-2-carbonyl]amino}butanoic acid
Cas Number: 1523530-65-5Formula: C19H20N2O4Molecular weight: 340.38Synonyms: MFCD27986926 | S-(+)-MHD COOH | AKOS025289640 | 4-[[(5S)-5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine...SMILES: C1C(C2=CC=CC=C2N(C3=CC=CC=C31)C(=O)NCCCC(=O)O)OInChIKey: GZCFGVXBUYHYKW-KRWDZBQOSA-NInChI: InChI=1S/C19H20N2O4/c22-17-12-13-6-1-3-8-15(13)21(16-9-4-2-7-14(16)17)19(25)20-11-5-10-18(23)24/h1-4,6-9,17,22H,5,10-12H2,(H,20,25)(H,23,24)/t17-/m0/s1
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5-(2-Furyl)-1,3-cyclohexanedione
Cas Number: 1774-11-4Formula: C10H10O3Molecular weight: 178.18Synonyms: 1774-11-4|5-(furan-2-yl)cyclohexane-1,3-dione|5-(2-furyl)cyclohexane-1,3-dione|5-(2-Furyl)-1,3-cyclo...SMILES: C1C(CC(=O)CC1=O)C2=CC=CO2InChIKey: FYLTVHCMIYGVPZ-UHFFFAOYSA-NInChI: InChI=1S/C10H10O3/c11-8-4-7(5-9(12)6-8)10-2-1-3-13-10/h1-3,7H,4-6H2
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Oxytetracycline Dihydrate
Cas Number: 6153-64-6(DMSO)Formula: C22H24N2O9·2H2OMolecular weight: 496.46Synonyms: (4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,�...SMILES: O.O.CN(C)C1C2C(O)C3C(=C(O)C2(O)C(=O)C(=C1O)C(N)=O)C(=O)C4=C(O)C=CC=C4C3(C)O
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Nevirapine (NSC 641530), Human immunodeficiency virus type 1 reverse transcriptase inhibitor
Cas Number: 129618-40-2(DMSO)Formula: C15H14N4OMolecular weight: 266.3Synonyms: 11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3,2-b:2',3'-e][...SMILES: CC1=CC=NC2=C1NC(=O)C3=C(N=CC=C3)N2C4CC4
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DAUDA
Cas Number: 73025-02-2Formula: C23H34N2O4SMolecular weight: 434.59Synonyms: 11-(5-(dimethylamino)naphthalene-1-sulfonamido)undecanoic acid | 11-[[5-(dimethylamino)naphthalen-1-...SMILES: CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCCCCCCCCCC(=O)OInChIKey: CEPGVMDMVJGHFQ-UHFFFAOYSA-NInChI: InChI=1S/C23H34N2O4S/c1-25(2)21-15-11-14-20-19(21)13-12-16-22(20)30(28,29)24-18-10-8-6-4-3-5-7-9-17-23(26)27/h11-16,24H,3-10,17-18H2,1-2H3,(H,26,27)
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