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Beta amino acids and derivatives
Description:
Amino acids having a (-NH2) group attached to the beta carbon atom.
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2,7-Diazaspiro[4.4]nonan-1-oneCas Number: 1203796-97-7 Compound CID: 55263205Formula: C7H12N2O Molecular Weight: 140.19SMILES: C1CNCC12CCNC2=O
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2-Benzyltetrahydropyrrolo[3,4-c]pyrrole-1,3-dioneCas Number: 86732-32-3 Compound CID: 12958507Formula: C13H14N2O2 Molecular Weight: 230.26IUPAC Name: 5-benzyl-2,3,3a,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole-4,6-dioneSMILES: C1C2C(CN1)C(=O)N(C2=O)CC3=CC=CC=C3InChIKey: LASIKWRVUBLQPO-UHFFFAOYSA-NInChI: InChI=1S/C13H14N2O2/c16-12-10-6-14-7-11(10)13(17)15(12)8-9-4-2-1-3-5-9/h1-5,10-11,14H,6-8H2
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2-(4-Amino-1-(tert-butoxycarbonyl)piperidin-4-yl)acetic acidCas Number: 1159983-30-8 Compound CID: 49759554Formula: C12H22N2O4 Molecular Weight: 258.31IUPAC Name: 2-[4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acidSMILES: CC(C)(C)OC(=O)N1CCC(CC1)(CC(=O)O)NInChIKey: BGBMNGXKKOJOSX-UHFFFAOYSA-NInChI: InChI=1S/C12H22N2O4/c1-11(2,3)18-10(17)14-6-4-12(13,5-7-14)8-9(15)16/h4-8,13H2,1-3H3,(H,15,16)
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(S)-Methyl 3-amino-3-phenylpropanoate hydrochlorideCas Number: 144494-72-4Formula: C10H14ClNO2 Molecular Weight: 215.67IUPAC Name: methyl (3S)-3-amino-3-phenylpropanoate;hydrochlorideSMILES: COC(=O)CC(C1=CC=CC=C1)N.ClInChIKey: GYKTZBZYSKZYDB-FVGYRXGTSA-NInChI: InChI=1S/C10H13NO2.ClH/c1-13-10(12)7-9(11)8-5-3-2-4-6-8;/h2-6,9H,7,11H2,1H3;1H/t9-;/m0./s1
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(S)-Ethyl 3-amino-3-phenylpropanoate hydrochlorideCas Number: 167834-24-4 Compound CID: 22831526Formula: C11H16ClNO2 Molecular Weight: 229.7IUPAC Name: ethyl (3S)-3-amino-3-phenylpropanoate;hydrochlorideSMILES: CCOC(=O)CC(C1=CC=CC=C1)N.ClInChIKey: ATSZQDTVNRNXKB-PPHPATTJSA-NInChI: InChI=1S/C11H15NO2.ClH/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9;/h3-7,10H,2,8,12H2,1H3;1H/t10-;/m0./s1
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(S)-3-((2R,5S)-5-(4-Fluorophenyl)-2-((S)-((4-fluorophenyl)amino)(4-((trimethylsilyl)oxy)phenyl)methyl)-5-((trimethylsilyl)oxy)pentanoyl)-4-phenyloxazolidin-2-oneFormula: C39H46F2N2O5Si2 Molecular Weight: 717IUPAC Name: show moreSMILES: C[Si](C)(C)OC1=CC=C(C=C1)C(C(CCC(C2=CC=C(C=C2)F)O[Si](C)(C)C)C(=O)N3C(COC3=O)C4=CC=CC=C4)NC5=CC=C(C=C5)FInChIKey: XXMINDVVBVJXLN-GOFGAPPUSA-NInChI: show more
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(S)-2-(Aminomethyl)-4-methylpentanoic acidCas Number: 203854-56-2 Compound CID: 55253004Formula: C7H15NO2 Molecular Weight: 145.2IUPAC Name: (2S)-2-(aminomethyl)-4-methylpentanoic acidSMILES: CC(C)CC(CN)C(=O)OInChIKey: IAXQYBCPMFDMOJ-LURJTMIESA-NInChI: InChI=1S/C7H15NO2/c1-5(2)3-6(4-8)7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t6-/m0/s1
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(S)-2-(Aminomethyl)-4-methylpentanoic acid hydrochlorideCas Number: 1276055-49-2 Compound CID: 56971760Formula: C7H16ClNO2 Molecular Weight: 181.66IUPAC Name: (2S)-2-(aminomethyl)-4-methylpentanoic acid;hydrochlorideSMILES: CC(C)CC(CN)C(=O)O.ClInChIKey: HZQWRYHUNMXMLF-RGMNGODLSA-NInChI: InChI=1S/C7H15NO2.ClH/c1-5(2)3-6(4-8)7(9)10;/h5-6H,3-4,8H2,1-2H3,(H,9,10);1H/t6-;/m0./s1
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(S)-2-(Aminomethyl)-3-methylbutanoic acidCas Number: 203854-54-0 Compound CID: 56971764Formula: C6H13NO2 Molecular Weight: 131.17IUPAC Name: (2S)-2-(aminomethyl)-3-methylbutanoic acidSMILES: CC(C)C(CN)C(=O)OInChIKey: UUQYMNPVPQLPID-RXMQYKEDSA-NInChI: InChI=1S/C6H13NO2/c1-4(2)5(3-7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1
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(R)-3-amino-4-(1H-indol-3-yl)butanoic acidCas Number: 736131-01-4 Compound CID: 5706679Formula: C12H14N2O2 Molecular Weight: 218.25IUPAC Name: (3R)-3-amino-4-(1H-indol-3-yl)butanoic acidSMILES: C1=CC=C2C(=C1)C(=CN2)CC(CC(=O)O)NInChIKey: DUVVFMLAHWNDJD-SECBINFHSA-NInChI: InChI=1S/C12H14N2O2/c13-9(6-12(15)16)5-8-7-14-11-4-2-1-3-10(8)11/h1-4,7,9,14H,5-6,13H2,(H,15,16)/t9-/m1/s1
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(R)-3-Aminobutanoic acid hydrochlorideCas Number: 58610-42-7Formula: C4H10ClNO2 Molecular Weight: 139.58IUPAC Name: (3R)-3-aminobutanoic acid;hydrochlorideSMILES: CC(CC(=O)O)N.ClInChIKey: UHYVVUABAWKTJJ-AENDTGMFSA-NInChI: InChI=1S/C4H9NO2.ClH/c1-3(5)2-4(6)7;/h3H,2,5H2,1H3,(H,6,7);1H/t3-;/m1./s1
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(3S)-3-amino-3-naphthalen-2-ylpropanoic acidCas Number: 767282-94-0Formula: C13H13NO2 Molecular Weight: 215.25IUPAC Name: (3S)-3-amino-3-naphthalen-2-ylpropanoic acidSMILES: C1=CC=C2C=C(C=CC2=C1)C(CC(=O)O)NInChIKey: JASNXOXPNZWQRV-LBPRGKRZSA-NInChI: InChI=1S/C13H13NO2/c14-12(8-13(15)16)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12H,8,14H2,(H,15,16)/t12-/m0/s1
