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Chiral Auxiliaries
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cis-1,2-CyclooctanediolCas Number: 27607-33-6Formula: C8H16O2 Molecular Weight: 144.21IUPAC Name: (1R,2S)-cyclooctane-1,2-diolSMILES: C1CCCC(C(CC1)O)OInChIKey: HUSOFJYAGDTKSK-OCAPTIKFSA-NInChI: InChI=1S/C8H16O2/c9-7-5-3-1-2-4-6-8(7)10/h7-10H,1-6H2/t7-,8+Synonyms: cis-1,2-Cyclooctanediol | cis-1,2-cyclo-octanediol | cis-1,2-Cyclooctanediol, 99% | 1,2-Cyclooctanediol, (1R,2S)-rel-...
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AJ-76 HCL, Antagonist of D 3 receptorCas Number: 85378-82-1Formula: C15H23NO•HCl Molecular Weight: 269.81IUPAC Name: (1S,2R)-5-methoxy-1-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochlorideSMILES: CCCNC1CCC2=C(C1C)C=CC=C2OC.ClInChIKey: KIRYNZFMOLYYQB-YECZQDJWSA-NInChI: InChI=1S/C15H23NO.ClH/c1-4-10-16-14-9-8-13-12(11(14)2)6-5-7-15(13)17-3;/h5-7,11,14,16H,4,8-10H2,1-3H3;1H/t11-,14+;/m0./s1Synonyms: SCHEMBL276252 | AJ76(+) | AJ76-(+) | 5-methoxy-1-methyl-2-(n-propylamino)tetralin | (1S,2R)-(5-Methoxy-1-methyl-1,2,3...
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N-(4-Trifluoromethylbenzyl)cinchoninium bromideCas Number: 95088-20-3 Compound CID: 11421253Formula: C27H28BrF3N2O Molecular Weight: 533.42IUPAC Name: (S)-[(2R,4S,5R)-5-ethenyl-1-[[4-(trifluoromethyl)phenyl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;bromideSMILES: C=CC1C[N+]2(CCC1CC2C(C3=CC=NC4=CC=CC=C34)O)CC5=CC=C(C=C5)C(F)(F)F.[Br-]InChIKey: LOCWWLLFHKDFLF-KFGLDPKJSA-MInChI: show more
Synonyms: (2R,4S,5R)-2-((S)-hydroxy(quinolin-4-yl)methyl)-1-(4-(trifluoromethyl)benzyl)-5-vinyl-1-azoniabicyclo[2.2.2]octane br... -
D-threo-1-(4-Aminophenyl)-2-dichloroacetylamino-1,3-propanediol HydrochlorideCas Number: 57704-36-6 Compound CID: 46780332Formula: C11H15Cl3N2O3 Molecular Weight: 329.61IUPAC Name: N-[(1R,2R)-1-(4-aminophenyl)-1,3-dihydroxypropan-2-yl]-2,2-dichloroacetamide;hydrochlorideSMILES: C1=CC(=CC=C1C(C(CO)NC(=O)C(Cl)Cl)O)N.ClInChIKey: AUVANTYWDCEWMP-VTLYIQCISA-NInChI: InChI=1S/C11H14Cl2N2O3.ClH/c12-10(13)11(18)15-8(5-16)9(17)6-1-3-7(14)4-2-6;/h1-4,8-10,16-17H,5,14H2,(H,15,18);1H/t8-,9-;/m1./s1Synonyms: N-[(1R,2R)-1-(4-aminophenyl)-1,3-dihydroxypropan-2-yl]-2,2-dichloroacetamide;hydrochloride | D-threo-1-(4-Aminophenyl...
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6-Chloro D-TryptophanCas Number: 56632-86-1Formula: C11H11ClN2O2 Molecular Weight: 238.67IUPAC Name: (2R)-2-amino-3-(6-chloro-1H-indol-3-yl)propanoic acidSMILES: C1=CC2=C(C=C1Cl)NC=C2CC(C(=O)O)NInChIKey: FICLVQOYKYBXFN-SECBINFHSA-NInChI: InChI=1S/C11H11ClN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m1/s1Synonyms: (2R)-2-amino-3-(6-chloro-1H-indol-3-yl)propanoic acid | CHEBI:140515 | (R)-2-Amino-3-(6-chloro-1H-indol-3-yl)-propion...
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10-Oxo DocetaxelCas Number: 167074-97-7 Compound CID: 15200439Formula: C43H51NO14 Molecular Weight: 805.86IUPAC Name: show more
SMILES: CC1=C2C(=O)C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)CInChIKey: ZOLQDWANVNOXBK-YYCGEXIESA-NInChI: show more Synonyms: MS-31487 | Docetaxel trihydrate impurity B [EP] | Docetaxel Impurity 1 | 10-Deoxy-10-oxodocetaxel | Docetaxel trihydr...
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Adipoyl-L-carnitine trifluoroacetateCas Number: 102636-83-9(free base) Compound CID: 154731578Formula: C₁₅H₂₄F₃NO₈ Molecular Weight: 403.35IUPAC Name: 6-[(2R)-1-carboxylato-3-(trimethylazaniumyl)propan-2-yl]oxy-6-oxohexanoate;hydronSMILES: [H+].C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCC(=O)[O-]InChIKey: BSVHAXJKBCWVDA-SNVBAGLBSA-NInChI: InChI=1S/C13H23NO6/c1-14(2,3)9-10(8-12(17)18)20-13(19)7-5-4-6-11(15)16/h10H,4-9H2,1-3H3,(H-,15,16,17,18)/t10-/m1/s1Synonyms: Adipoylcarnitine | O-adipoyl-L-carnitine | Adipoyl-L-carnitine | YV1E6O6OZV | UNII-YV1E6O6OZV
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3-Hydroxy RopivacaineCas Number: 163589-30-8Formula: C17H26N2O2 Molecular Weight: 290.41IUPAC Name: N-(3-hydroxy-2,6-dimethylphenyl)-1-propylpiperidine-2-carboxamideSMILES: CCCN1CCCCC1C(=O)NC2=C(C=CC(=C2C)O)CInChIKey: IXOVDWXTIIYVOJ-UHFFFAOYSA-NInChI: InChI=1S/C17H26N2O2/c1-4-10-19-11-6-5-7-14(19)17(21)18-16-12(2)8-9-15(20)13(16)3/h8-9,14,20H,4-7,10-11H2,1-3H3,(H,18,21)Synonyms: 3'-Hydroxyropivacaine | (2S)-N-(3-Hydroxy-2,6-dimethylphenyl)-1-propyl-2-piperidinecarboxamide | J-010066 | FT-067010...
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(S)-(-)-2-Methyl-2-propanesulfinamideCas Number: 343338-28-3Formula: C4H11NOS Molecular Weight: 121.2IUPAC Name: (S)-2-methylpropane-2-sulfinamideSMILES: CC(C)(C)S(=O)NInChIKey: CESUXLKAADQNTB-ZETCQYMHSA-NInChI: InChI=1S/C4H11NOS/c1-4(2,3)7(5)6/h5H2,1-3H3/t7-/m0/s1Synonyms: r-(+)-tert-butylsulfinamide | AKOS005137934 | (s)-(-)-2-methyl-2-propane sulfinamide | AKOS015897477 | (S)-2-methyl-2...
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(S)-1-(4-Chlorophenyl)ethylamineCas Number: 4187-56-8Formula: C8H10ClN Molecular Weight: 155.62IUPAC Name: (1S)-1-(4-chlorophenyl)ethanamineSMILES: CC(C1=CC=C(C=C1)Cl)NInChIKey: PINPOEWMCLFRRB-LURJTMIESA-NInChI: InChI=1S/C8H10ClN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H3/t6-/m0/s1Synonyms: (1S)-1-(4-chlorophenyl)ethan-1-amine | (1~{R})-1-(4-chlorophenyl)ethanamine | (S)-1-(4-chloro-phenyl)-ethyl amine | (...
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Deoxynivalenol Quality Control SampleCas Number: 51481-10-8Formula: C15H20O6 Molecular Weight: 296.32IUPAC Name: (1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-oneSMILES: CC1=CC2C(C(C1=O)O)(C3(CC(C(C34CO4)O2)O)C)COInChIKey: LINOMUASTDIRTM-QGRHZQQGSA-NInChI: InChI=1S/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3/t8-,9-,11-,12-,13-,14-,15+/m1/s1Synonyms: DEOXYNIVALENOL|51481-10-8|Vomitoxin|Dehydronivalenol|4-Deoxynivalenol|4-Desoxynivalenol|Desoxynivalenol|Rd toxin|JT37...
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(4S,5R)-(-)-4-Methyl-5-phenyl-2-oxazolidinoneCas Number: 16251-45-9Formula: C10H11NO2 Molecular Weight: 177.2IUPAC Name: (4S,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-oneSMILES: CC1C(OC(=O)N1)C2=CC=CC=C2InChIKey: PPIBJOQGAJBQDF-CBAPKCEASA-NInChI: InChI=1S/C10H11NO2/c1-7-9(13-10(12)11-7)8-5-3-2-4-6-8/h2-7,9H,1H3,(H,11,12)/t7-,9-/m0/s1Synonyms: (4S,5R)-4-methyl-5-phenyl-oxazolidin-2-one | (4S,5R)-4-Methyl-5-phenyloxazolidin-2-one | AC-33543 | cis-4-Methyl-5-ph...
