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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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N-(2-Hydroxyethyl)ethylenediamine-N,N′,N′-triacetic acidCas Number: 150-39-0 EC Number: 205-759-3Formula: HOCH2CH2N(CH2CO2H)CH2CH2N(CH2CO2H)2 Molecular Weight: 278.26IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(2-hydroxyethyl)amino]acetic acidSMILES: C(CN(CC(=O)O)CC(=O)O)N(CCO)CC(=O)OInChIKey: URDCARMUOSMFFI-UHFFFAOYSA-NInChI: InChI=1S/C10H18N2O7/c13-4-3-11(5-8(14)15)1-2-12(6-9(16)17)7-10(18)19/h13H,1-7H2,(H,14,15)(H,16,17)(H,18,19)
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Cobicistat (GS-9350)Cas Number: 1004316-88-4Formula: C40H53N7O5S2 Molecular Weight: 776.02IUPAC Name: show moreSMILES: CC(C)C1=NC(=CS1)CN(C)C(=O)NC(CCN2CCOCC2)C(=O)NC(CCC(CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)CC5=CC=CC=C5InChIKey: ZCIGNRJZKPOIKD-CQXVEOKZSA-NInChI: show moreSynonyms: GS-9350 | GS 9350 | GS9350 | (3R,6R,9S)-12-Methyl-13-[2-(1-methylethyl)-4-thiazolyl]-9-[2-(4-morpholinyl)ethyl]-8,11-...
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Nafcillin sodium salt monohydrateCas Number: 7177-50-6Formula: C21H21N2O5SNa·H2O Molecular Weight: 454.47IUPAC Name: sodium;(2S,5R,6R)-6-[(2-ethoxynaphthalene-1-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;hydrateSMILES: CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)[O-].O.[Na+]InChIKey: OCXSDHJRMYFTMA-KMFBOIRUSA-MInChI: show moreSynonyms: Sodium (2S,5R,6R)-6-[(2-ethoxynaphthalene-1-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-ca...
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Mezlocillin SodiumCas Number: 42057-22-7 Compound CID: 23685177Formula: C21H24N5NaO8S2 Molecular Weight: 561.56IUPAC Name: show moreSMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)N4CCN(C4=O)S(=O)(=O)C)C(=O)[O-])C.[Na+]InChIKey: GTGQRSIMEUWHPA-ZBJAFUORSA-MInChI: show moreSynonyms: BAY-f 1353 sodium | [2S-[2alpha,5alpha,6beta(S*)]]-3,3-Dimethyl-6-[[[[[3-(Methylsulfonyl)-2-Oxo-1-Imidazolidinyl]Carb...
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γ-Glu-Phe,γ-GlutamylphenylalanineCas Number: 7432-24-8 Compound CID: 111299Formula: C₁₄H₁₈N₂O₅・C2HF3O₂ Molecular Weight: 408.32IUPAC Name: (2S)-2-amino-5-[[(1S)-1-carboxy-2-phenylethyl]amino]-5-oxopentanoic acidSMILES: C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCC(C(=O)O)NInChIKey: XHHOHZPNYFQJKL-QWRGUYRKSA-NInChI: InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1
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α-ketoglutaric acid di-L-arginine saltCas Number: 5256-76-8Formula: C5H6O5*2C6H14N4O2 Molecular Weight: 494.505SMILES: C(CC(C(=O)O)N)CN=C(N)N.C(CC(C(=O)O)N)CN=C(N)N.C(CC(=O)O)C(=O)C(=O)OInChIKey: NCRWNFFIHNRODM-SCGRZTRASA-NInChI: InChI=1S/2C6H14N4O2.C5H6O5/c2*7-4(5(11)12)2-1-3-10-6(8)9;6-3(5(9)10)1-2-4(7)8/h2*4H,1-3,7H2,(H,11,12)(H4,8,9,10);1-2H2,(H,7,8)(H,9,10)/t2*4-;/m00./s1
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tert-Butyl 4-((1R,2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxamido)piperidine-1-carboxylateCas Number: 1174020-64-4Formula: C17H28N4O5 Molecular Weight: 368.43SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2CCC3CN2C(=O)N3OInChIKey: SXKJDJFTBGADNS-OLZOCXBDSA-NInChI: InChI=1S/C17H28N4O5/c1-17(2,3)26-16(24)19-8-6-11(7-9-19)18-14(22)13-5-4-12-10-20(13)15(23)21(12)25/h11-13,25H,4-10H2,1-3H3,(H,18,22)/t12-,13+/m1/s1
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ThiorphanCas Number: 76721-89-6Formula: C12H15NO3S Molecular Weight: 253.32IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)amino]acetic acidSMILES: C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)OInChIKey: LJJKNPQAGWVLDQ-UHFFFAOYSA-NInChI: InChI=1S/C12H15NO3S/c14-11(15)7-13-12(16)10(8-17)6-9-4-2-1-3-5-9/h1-5,10,17H,6-8H2,(H,13,16)(H,14,15)Synonyms: 2-(2-Benzyl-3-mercaptopropanamido)acetic acid | (±)-N-(3-Mercapto-2-benzylpropionyl)glycine | DL-3-Mercapto-2-benzylp...
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Z-Val-OEtCas Number: 67436-18-4 Compound CID: 11087140Formula: C15H21NO4 Molecular Weight: 279.33IUPAC Name: ethyl (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoateSMILES: CCOC(=O)C(C(C)C)NC(=O)OCC1=CC=CC=C1InChIKey: KZBMEQVWSYFMNC-ZDUSSCGKSA-NInChI: InChI=1S/C15H21NO4/c1-4-19-14(17)13(11(2)3)16-15(18)20-10-12-8-6-5-7-9-12/h5-9,11,13H,4,10H2,1-3H3,(H,16,18)/t13-/m0/s1
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benzyl (2S)-2-amino-6-(phenylmethoxycarbonylamino)hexanoate,4-methylbenzenesulfonic acidCas Number: 16964-83-3 Compound CID: 53230052Formula: C28H34N2O7S Molecular Weight: 542.66IUPAC Name: benzyl (2S)-2-amino-6-(phenylmethoxycarbonylamino)hexanoate;4-methylbenzenesulfonic acidSMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)C(CCCCNC(=O)OCC2=CC=CC=C2)NInChIKey: PPZYKJHWKVREOQ-FYZYNONXSA-NInChI: show more
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Perindopril L-ArginineCas Number: 612548-45-5 Compound CID: 12068809Formula: C25H46N6O7 Molecular Weight: 542.67IUPAC Name: show moreSMILES: CCCC(C(=O)OCC)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O.C(CC(C(=O)O)N)CN=C(N)NInChIKey: RYCSJJXKEWBUTI-YDYAIEMNSA-NInChI: show more
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Phenylalanine betaineCas Number: 56755-22-7 Compound CID: 25837691IUPAC Name: (2S)-3-phenyl-2-(trimethylazaniumyl)propanoateSMILES: C[N+](C)(C)C(CC1=CC=CC=C1)C(=O)[O-]InChIKey: XTFQIRIHLGODFV-NSHDSACASA-NInChI: InChI=1S/C12H17NO2/c1-13(2,3)11(12(14)15)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3/t11-/m0/s1
