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Alpha amino acids and derivatives
Description:
Amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
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(R)-2-(diMethylaMino)-3-Methylbutanoic acidCas Number: 899900-52-8Formula: C7H15NO2 Molecular Weight: 145.1995SMILES: CC(C)C(C(=O)O)N(C)CInChIKey: APGLTERDKORUHK-ZCFIWIBFSA-NInChI: InChI=1S/C7H15NO2/c1-5(2)6(7(9)10)8(3)4/h5-6H,1-4H3,(H,9,10)/t6-/m1/s1
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(R)-2-(((Benzyloxy)carbonyl)(methyl)amino)-4-methylpentanoic acidCas Number: 65635-85-0 Compound CID: 7018058Formula: C15H21NO4 Molecular Weight: 279.33IUPAC Name: (2R)-4-methyl-2-[methyl(phenylmethoxycarbonyl)amino]pentanoic acidSMILES: CC(C)CC(C(=O)O)N(C)C(=O)OCC1=CC=CC=C1InChIKey: TVXSGOBGRXNJLM-CYBMUJFWSA-NInChI: InChI=1S/C15H21NO4/c1-11(2)9-13(14(17)18)16(3)15(19)20-10-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H,17,18)/t13-/m1/s1
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(R)-2-((tert-Butoxycarbonyl)(methyl)amino)butanoic acidCas Number: 287210-80-4 Compound CID: 58615437Formula: C10H19NO4 Molecular Weight: 217.27IUPAC Name: (2R)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoic acidSMILES: CCC(C(=O)O)N(C)C(=O)OC(C)(C)CInChIKey: QIXDRLIEARGEQY-SSDOTTSWSA-NInChI: InChI=1S/C10H19NO4/c1-6-7(8(12)13)11(5)9(14)15-10(2,3)4/h7H,6H2,1-5H3,(H,12,13)/t7-/m1/s1
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(R)-2-Amino-4-cyclohexylbutanoic acidCas Number: 728880-26-0 Compound CID: 40784829Formula: C10H19NO2 Molecular Weight: 185.26IUPAC Name: (2R)-2-amino-4-cyclohexylbutanoic acidSMILES: C1CCC(CC1)CCC(C(=O)O)NInChIKey: MXHKOHWUQAULOV-SECBINFHSA-NInChI: InChI=1S/C10H19NO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h8-9H,1-7,11H2,(H,12,13)/t9-/m1/s1
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(R)-tert-Butyl 2-methyl-3-oxopiperazine-1-carboxylateCas Number: 1629229-82-8 Compound CID: 10584738Formula: C10H18N2O3 Molecular Weight: 214.26IUPAC Name: tert-butyl (2R)-2-methyl-3-oxopiperazine-1-carboxylateSMILES: CC1C(=O)NCCN1C(=O)OC(C)(C)CInChIKey: KKVKQTLLEBWZTR-SSDOTTSWSA-NInChI: InChI=1S/C10H18N2O3/c1-7-8(13)11-5-6-12(7)9(14)15-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,13)/t7-/m1/s1
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(R)-2-Amino-2-(4-fluorophenyl)acetic acid hydrochlorideCas Number: 144744-41-2 Compound CID: 53484792IUPAC Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid;hydrochlorideSMILES: C1=CC(=CC=C1C(C(=O)O)N)F.ClInChIKey: AAUCORGIJVVECX-OGFXRTJISA-NInChI: InChI=1S/C8H8FNO2.ClH/c9-6-3-1-5(2-4-6)7(10)8(11)12;/h1-4,7H,10H2,(H,11,12);1H/t7-;/m1./s1
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(R)-Benzyl 2-amino-3-(4-hydroxyphenyl)propanoate 4-methylbenzenesulfonateCas Number: 97984-63-9 Compound CID: 56777385Formula: C23H25NO6S Molecular Weight: 443.5IUPAC Name: benzyl (2R)-2-amino-3-(4-hydroxyphenyl)propanoate;4-methylbenzenesulfonic acidSMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)C(CC2=CC=C(C=C2)O)NInChIKey: PJGVHBLZZQDFFM-XFULWGLBSA-NInChI: show more
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(S)-1-[2-(Boc-amino)acetyl]-4,4-difluoropyrrolidine-2-carbonitrileCas Number: 1448440-50-3Formula: C12H17F2N3O3 Molecular Weight: 289.28SMILES: CC(C)(C)OC(=O)NCC(=O)N1CC(CC1C#N)(F)FInChIKey: WOOAQTYGIARQIQ-QMMMGPOBSA-NInChI: InChI=1S/C12H17F2N3O3/c1-11(2,3)20-10(19)16-6-9(18)17-7-12(13,14)4-8(17)5-15/h8H,4,6-7H2,1-3H3,(H,16,19)/t8-/m0/s1
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o-OxalotoluidideCas Number: 3299-62-5 Compound CID: 223396Formula: C16H16N2O2IUPAC Name: N,N'-bis(2-methylphenyl)oxamideSMILES: CC1=CC=CC=C1NC(=O)C(=O)NC2=CC=CC=C2CInChIKey: CURRJRVNHCZZST-UHFFFAOYSA-NInChI: InChI=1S/C16H16N2O2/c1-11-7-3-5-9-13(11)17-15(19)16(20)18-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H,17,19)(H,18,20)
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ethyl 2-amino-3-hydroxy-3-phenylpropanoate hydrochlorideCas Number: 42267-16-3Formula: C11H16ClNO3 Molecular Weight: 245.7026SMILES: CCOC(=O)C(C(C1=CC=CC=C1)O)N.ClInChIKey: PKHKERPKLCPPGI-UHFFFAOYSA-NInChI: InChI=1S/C11H15NO3.ClH/c1-2-15-11(14)9(12)10(13)8-6-4-3-5-7-8;/h3-7,9-10,13H,2,12H2,1H3;1H
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ethyl 2-(2-methyl-4-nitro-imidazol-1-yl)acetateCas Number: 13230-22-3 Compound CID: 25792Formula: C8H11N3O4 Molecular Weight: 213.193IUPAC Name: ethyl 2-(2-methyl-4-nitroimidazol-1-yl)acetateSMILES: CCOC(=O)CN1C=C(N=C1C)[N+](=O)[O-]InChIKey: XMPREPGUGSKZIE-UHFFFAOYSA-NInChI: InChI=1S/C8H11N3O4/c1-3-15-8(12)5-10-4-7(11(13)14)9-6(10)2/h4H,3,5H2,1-2H3
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Suc-Phe-pNACas Number: 2440-62-2 Compound CID: 102818Formula: C19H19N3O6 Molecular Weight: 385.37IUPAC Name: 4-[[1-(4-nitroanilino)-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acidSMILES: C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCC(=O)OInChIKey: KNBLWBFJHZHYFG-UHFFFAOYSA-NInChI: InChI=1S/C19H19N3O6/c23-17(10-11-18(24)25)21-16(12-13-4-2-1-3-5-13)19(26)20-14-6-8-15(9-7-14)22(27)28/h1-9,16H,10-12H2,(H,20,26)(H,21,23)(H,24,25)
