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Phenylalanine and derivatives
Description:
Compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
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N-(tert-Butoxycarbonyl)-O-ethyltyrosineCas Number: 247088-44-4Formula: C16H23NO5 Molecular Weight: 309.37IUPAC Name: 3-(4-ethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CCOC1=CC=C(C=C1)CC(C(=O)O)NC(=O)OC(C)(C)CInChIKey: NCLAAKQIHUIOIV-UHFFFAOYSA-NInChI: InChI=1S/C16H23NO5/c1-5-21-12-8-6-11(7-9-12)10-13(14(18)19)17-15(20)22-16(2,3)4/h6-9,13H,5,10H2,1-4H3,(H,17,20)(H,18,19) -
Methyl 2-amino-3-(3-hydroxyphenyl)propanoate hydrochlorideCas Number: 34260-70-3 Compound CID: 45040666Formula: C10H14ClNO3 Molecular Weight: 231.67IUPAC Name: methyl 2-amino-3-(3-hydroxyphenyl)propanoate;hydrochlorideSMILES: COC(=O)C(CC1=CC(=CC=C1)O)N.ClInChIKey: WULJQXTZWBDFSE-UHFFFAOYSA-NInChI: InChI=1S/C10H13NO3.ClH/c1-14-10(13)9(11)6-7-3-2-4-8(12)5-7;/h2-5,9,12H,6,11H2,1H3;1H
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L-Phenylalanine hydrochlorideCas Number: 17585-69-2 Compound CID: 12000150Formula: C9H12ClNO2 Molecular Weight: 201.65IUPAC Name: (2S)-2-amino-3-phenylpropanoic acid;hydrochlorideSMILES: C1=CC=C(C=C1)CC(C(=O)O)N.ClInChIKey: ZAIZDXVMSSDZFA-QRPNPIFTSA-NInChI: InChI=1S/C9H11NO2.ClH/c10-8(9(11)12)6-7-4-2-1-3-5-7;/h1-5,8H,6,10H2,(H,11,12);1H/t8-;/m0./s1
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L-Phenylalanine allyl ester 4-toluenesulfonate saltCas Number: 88224-00-4 Compound CID: 45072173Formula: C19H23NO5S Molecular Weight: 377.46IUPAC Name: 4-methylbenzenesulfonic acid;prop-2-enyl (2S)-2-amino-3-phenylpropanoateSMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C=CCOC(=O)C(CC1=CC=CC=C1)NInChIKey: PKXPRZFLCJFMHN-MERQFXBCSA-NInChI: InChI=1S/C12H15NO2.C7H8O3S/c1-2-8-15-12(14)11(13)9-10-6-4-3-5-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h2-7,11H,1,8-9,13H2;2-5H,1H3,(H,8,9,10)/t11-;/m0./s1
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H-DL-Phe-OEt.HClCas Number: 19881-53-9Formula: C11H16ClNO2 Molecular Weight: 229.7IUPAC Name: ethyl 2-amino-3-phenylpropanoate;hydrochlorideSMILES: CCOC(=O)C(CC1=CC=CC=C1)N.ClInChIKey: FPFQPLFYTKMCHN-UHFFFAOYSA-NInChI: InChI=1S/C11H15NO2.ClH/c1-2-14-11(13)10(12)8-9-6-4-3-5-7-9;/h3-7,10H,2,8,12H2,1H3;1H
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D-2-CyanophenylalanineCas Number: 263396-41-4Formula: C10H10N2O2 Molecular Weight: 190.20IUPAC Name: (2R)-2-amino-3-(2-cyanophenyl)propanoic acidSMILES: C1=CC=C(C(=C1)CC(C(=O)O)N)C#NInChIKey: OCDHPLVCNWBKJN-SECBINFHSA-NInChI: InChI=1S/C10H10N2O2/c11-6-8-4-2-1-3-7(8)5-9(12)10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m1/s1Synonyms: (R)-2-Amino-3-(2-cyanophenyl)propanoic acid | H-D-Phe(2-CN)-OH；D-Phe(2-CN)-OH
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D-4-BenzoylphenylalanineCas Number: 201466-03-7IUPAC Name: (2R)-2-amino-3-(4-benzoylphenyl)propanoic acidSMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CC(C(=O)O)NInChIKey: TVIDEEHSOPHZBR-CQSZACIVSA-NInChI: InChI=1S/C16H15NO3/c17-14(16(19)20)10-11-6-8-13(9-7-11)15(18)12-4-2-1-3-5-12/h1-9,14H,10,17H2,(H,19,20)/t14-/m1/s1
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Boc-Phe(4-I)-OmeCas Number: 113850-76-3 Compound CID: 10319078Formula: C15H20INO4 Molecular Weight: 405.23IUPAC Name: methyl (2S)-3-(4-iodophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoateSMILES: CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)I)C(=O)OCInChIKey: HNCUXLSIVYDGBW-LBPRGKRZSA-NInChI: InChI=1S/C15H20INO4/c1-15(2,3)21-14(19)17-12(13(18)20-4)9-10-5-7-11(16)8-6-10/h5-8,12H,9H2,1-4H3,(H,17,19)/t12-/m0/s1
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Boc-Phe(4-NH2)-OMeCas Number: 65615-90-9 Compound CID: 11011855Formula: C15H22N2O4 Molecular Weight: 294.35IUPAC Name: methyl (2S)-3-(4-aminophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoateSMILES: CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)N)C(=O)OCInChIKey: UUSXEIQYCSXKPN-LBPRGKRZSA-NInChI: InChI=1S/C15H22N2O4/c1-15(2,3)21-14(19)17-12(13(18)20-4)9-10-5-7-11(16)8-6-10/h5-8,12H,9,16H2,1-4H3,(H,17,19)/t12-/m0/s1
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2-((tert-butoxycarbonyl)amino)-3-(4-cyanophenyl)propanoic acidCas Number: 135414-03-8Formula: C15H18N2O4 Molecular Weight: 290.31IUPAC Name: 3-(4-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C#N)C(=O)OInChIKey: RMBLTLXJGNILPG-UHFFFAOYSA-NInChI: InChI=1S/C15H18N2O4/c1-15(2,3)21-14(20)17-12(13(18)19)8-10-4-6-11(9-16)7-5-10/h4-7,12H,8H2,1-3H3,(H,17,20)(H,18,19)
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2-((tert-butoxycarbonyl)amino)-3-(p-tolyl)propanoic acidCas Number: 110762-12-4IUPAC Name: 3-(4-methylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC1=CC=C(C=C1)CC(C(=O)O)NC(=O)OC(C)(C)CInChIKey: JYRWNPUFECDJCX-UHFFFAOYSA-NInChI: InChI=1S/C15H21NO4/c1-10-5-7-11(8-6-10)9-12(13(17)18)16-14(19)20-15(2,3)4/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)
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2-((tert-butoxycarbonyl)amino)-3-(3-cyanophenyl)propanoic acidCas Number: 191872-32-9IUPAC Name: 3-(3-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC(C)(C)OC(=O)NC(CC1=CC(=CC=C1)C#N)C(=O)OInChIKey: FDQDHMZKOPOWFE-UHFFFAOYSA-NInChI: InChI=1S/C15H18N2O4/c1-15(2,3)21-14(20)17-12(13(18)19)8-10-5-4-6-11(7-10)9-16/h4-7,12H,8H2,1-3H3,(H,17,20)(H,18,19)
