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Proline and derivatives
Description:
Compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
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(2S,4R)-4-Amino-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylicacidCas Number: 132622-69-6 Compound CID: 14842625Formula: C10H18N2O4 Molecular Weight: 230.26IUPAC Name: (2S,4R)-4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acidSMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)NInChIKey: WDWRIVZIPSHUOR-RQJHMYQMSA-NInChI: InChI=1S/C10H18N2O4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5,11H2,1-3H3,(H,13,14)/t6-,7+/m1/s1
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(2S,4S)-4-Fluoropyrrolidine-2-carboxamideCas Number: 748165-40-4 Compound CID: 12066286Formula: C5H9FN2O Molecular Weight: 132.14IUPAC Name: (2S,4S)-4-fluoropyrrolidine-2-carboxamideSMILES: C1C(CNC1C(=O)N)FInChIKey: UMTORPRXIWIVFS-IMJSIDKUSA-NInChI: InChI=1S/C5H9FN2O/c6-3-1-4(5(7)9)8-2-3/h3-4,8H,1-2H2,(H2,7,9)/t3-,4-/m0/s1
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(2S,4R)-4-Hydroxypyrrolidine-2-carboxamideCas Number: 61703-38-6Formula: C5H10N2O2 Molecular Weight: 130.15IUPAC Name: (2S,4R)-4-hydroxypyrrolidine-2-carboxamideSMILES: C1C(CNC1C(=O)N)OInChIKey: OJSXAYGYRGXDSQ-DMTCNVIQSA-NInChI: InChI=1S/C5H10N2O2/c6-5(9)4-1-3(8)2-7-4/h3-4,7-8H,1-2H2,(H2,6,9)/t3-,4+/m1/s1
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(2R,4S)-4-Amino-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acidCas Number: 132622-78-7 Compound CID: 14842627Formula: C10H18N2O4 Molecular Weight: 230.264IUPAC Name: (2R,4S)-4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acidSMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)NInChIKey: WDWRIVZIPSHUOR-NKWVEPMBSA-NInChI: InChI=1S/C10H18N2O4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5,11H2,1-3H3,(H,13,14)/t6-,7+/m0/s1
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rel-(2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acidCas Number: 2085759-54-0Formula: C10H16FNO4 Molecular Weight: 233.24IUPAC Name: (2S,4R)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acidSMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)FInChIKey: YGWZXQOYEBWUTH-RQJHMYQMSA-NInChI: InChI=1S/C10H16FNO4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5H2,1-3H3,(H,13,14)/t6-,7+/m1/s1
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Z-D-CIS-HYP-OHCas Number: 130930-25-5Formula: C13H15NO5 Molecular Weight: 265.26IUPAC Name: (2R,4R)-4-hydroxy-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acidSMILES: C1C(CN(C1C(=O)O)C(=O)OCC2=CC=CC=C2)OInChIKey: WWVCWLBEARZMAH-GHMZBOCLSA-NInChI: InChI=1S/C13H15NO5/c15-10-6-11(12(16)17)14(7-10)13(18)19-8-9-4-2-1-3-5-9/h1-5,10-11,15H,6-8H2,(H,16,17)/t10-,11-/m1/s1
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N-Methyl-D-proline HydrochlorideCas Number: 702710-17-6 Compound CID: 53393776Formula: C6H12ClNO2 Molecular Weight: 165.62IUPAC Name: (2R)-1-methylpyrrolidine-2-carboxylic acid;hydrochlorideSMILES: CN1CCCC1C(=O)O.ClInChIKey: ZHNOJJGMMVVUGM-NUBCRITNSA-NInChI: InChI=1S/C6H11NO2.ClH/c1-7-4-2-3-5(7)6(8)9;/h5H,2-4H2,1H3,(H,8,9);1H/t5-;/m1./s1
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(S)-1-carbamoylpyrrolidine-2-carboxylic acidCas Number: 38605-65-1Formula: C6H10N2O3 Molecular Weight: 158.16IUPAC Name: (2S)-1-carbamoylpyrrolidine-2-carboxylic acidSMILES: C1CC(N(C1)C(=O)N)C(=O)OInChIKey: RTNFBJXLYMERBB-BYPYZUCNSA-NInChI: InChI=1S/C6H10N2O3/c7-6(11)8-3-1-2-4(8)5(9)10/h4H,1-3H2,(H2,7,11)(H,9,10)/t4-/m0/s1
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(2R,4S)-4-Benzyl-1-(Tert-Butoxycarbonyl)Pyrrolidine-2-Carboxylic AcidCas Number: 1229439-64-8 Compound CID: 2761964IUPAC Name: (2S,4R)-4-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acidSMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)CC2=CC=CC=C2InChIKey: JPNHKKRLLDYCIZ-KGLIPLIRSA-NInChI: InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-11-13(10-14(18)15(19)20)9-12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3,(H,19,20)/t13-,14+/m1/s1
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(2R,4S)-4-Aminopyrrolidine-2-carboxylic acid dihydrochlorideCas Number: 2829279-78-7 Compound CID: 45072446Formula: C5H12Cl2N2O2 Molecular Weight: 203.06IUPAC Name: (2R,4S)-4-aminopyrrolidine-2-carboxylic acid;dihydrochlorideSMILES: C1C(CNC1C(=O)O)N.Cl.ClInChIKey: YQEVKNLEXCXBHR-WTIKUKJPSA-NInChI: InChI=1S/C5H10N2O2.2ClH/c6-3-1-4(5(8)9)7-2-3;;/h3-4,7H,1-2,6H2,(H,8,9);2*1H/t3-,4+;;/m0../s1
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1-Benzylpyrrolidine-2-carboxylic acidCas Number: 60169-72-4 Compound CID: 562952Formula: C12H15NO2 Molecular Weight: 205.25IUPAC Name: 1-benzylpyrrolidine-2-carboxylic acidSMILES: C1CC(N(C1)CC2=CC=CC=C2)C(=O)OInChIKey: XNROFTAJEGCDCT-UHFFFAOYSA-NInChI: InChI=1S/C12H15NO2/c14-12(15)11-7-4-8-13(11)9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H,14,15)Synonyms: DL-N-Benzylproline | N-benzylproline | (2S)-1-(benzyl)proline | (2S)-1-(benzyl)pyrrolidin-1-ium-2-carboxylate | (2S)-...
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(S)-5-Oxopyrrolidine-2-carboxamideCas Number: 16395-57-6Formula: C5H8N2O2 Molecular Weight: 128.13IUPAC Name: (2S)-5-oxopyrrolidine-2-carboxamideSMILES: C1CC(=O)NC1C(=O)NInChIKey: WGOIHPRRFBCVBZ-VKHMYHEASA-NInChI: InChI=1S/C5H8N2O2/c6-5(9)3-1-2-4(8)7-3/h3H,1-2H2,(H2,6,9)(H,7,8)/t3-/m0/s1

