N-acyl-alpha amino acids

Description:

Compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

Ancestors:

Organic compounds ⮕ Organic acids and derivatives ⮕ Carboxylic acids and derivatives ⮕ Amino acids, peptides, and analogues ⮕ Amino acids and derivatives ⮕ Alpha amino acids and derivatives ⮕ N-acyl-alpha amino acids and derivatives ⮕ N-acyl-alpha amino acids

Pivalopril
- ≥99%
Cas Number: 81045-50-3 Compound CID: 6917956

Formula: C₁₆H₂₇NO₄S Molecular Weight: 329.45

IUPAC Name: 2-[cyclopentyl-[(2S)-3-(2,2-dimethylpropanoylsulfanyl)-2-methylpropanoyl]amino]acetic acid

SMILES: CC(CSC(=O)C(C)(C)C)C(=O)N(CC(=O)O)C1CCCC1

InChIKey: XRKXJJYSKUIIEN-LLVKDONJSA-N

InChI: InChI=1S/C16H27NO4S/c1-11(10-22-15(21)16(2,3)4)14(20)17(9-13(18)19)12-7-5-6-8-12/h11-12H,5-10H2,1-4H3,(H,18,19)/t11-/m1/s1

Synonyms: 2-[cyclopentyl-[(2S)-3-(2,2-dimethylpropanoylsulanyl)-2-methylpropanoyl]amino]acetic acid | CHEBI:188840 | STK347863 ...
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N-Acetyl-S-(carbamoylethyl)-L-cysteine-d3
Cas Number: 1795786-57-0

Formula: C₈H₁₁D₃N₂O₄S Molecular Weight: 237.29

IUPAC Name: (2R)-3-(3-amino-3-oxopropyl)sulfanyl-2-[(2,2,2-trideuterioacetyl)amino]propanoic acid

SMILES: CC(=O)NC(CSCCC(=O)N)C(=O)O

InChIKey: GGBCHNJZQQEQRX-FYFSCIFKSA-N

InChI: InChI=1S/C8H14N2O4S/c1-5(11)10-6(8(13)14)4-15-3-2-7(9)12/h6H,2-4H2,1H3,(H2,9,12)(H,10,11)(H,13,14)/t6-/m0/s1/i1D3

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amyloid P-IN-1
- ≥99%
Cas Number: 1819986-22-5 Compound CID: 92136018

Formula: C₃₀H₄₄N₂O₁₄ Molecular Weight: 656.68

IUPAC Name: oxan-4-yloxycarbonyloxymethyl (2R)-1-[6-[(2R)-2-(oxan-4-yloxycarbonyloxymethoxycarbonyl)pyrrolidin-1-yl]-6-oxohexanoyl]pyrrolidine-2-carboxylate

SMILES: C1CC(N(C1)C(=O)CCCCC(=O)N2CCCC2C(=O)OCOC(=O)OC3CCOCC3)C(=O)OCOC(=O)OC4CCOCC4

InChIKey: KSKLDMGKWDUQCT-DNQXCXABSA-N

InChI: InChI=1S/C30H44N2O14/c33-25(31-13-3-5-23(31)27(35)41-19-43-29(37)45-21-9-15-39-16-10-21)7-1-2-8-26(34)32-14-4-6-24(32)28(36)42-20-44-30(38)46-22-11-17show more
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KCC2 blocker 1
- ≥98%
Cas Number: 1228439-36-8 Compound CID: 46866400

Formula: C₂₂H₂₅NO₅S Molecular Weight: 415.50

IUPAC Name: benzyl 1-acetyl-2-[(4-methylsulfonylphenyl)methyl]pyrrolidine-2-carboxylate

SMILES: CC(=O)N1CCCC1(CC2=CC=C(C=C2)S(=O)(=O)C)C(=O)OCC3=CC=CC=C3

InChIKey: XFXZWVGQXNFWDE-UHFFFAOYSA-N

InChI: InChI=1S/C22H25NO5S/c1-17(24)23-14-6-13-22(23,21(25)28-16-19-7-4-3-5-8-19)15-18-9-11-20(12-10-18)29(2,26)27/h3-5,7-12H,6,13-16H2,1-2H3
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Rentiapril
- ≥99%
Cas Number: 80830-42-8 Compound CID: 71244

Formula: C₁₃H₁₅NO₄S₂ Molecular Weight: 313.39

IUPAC Name: (2R,4R)-2-(2-hydroxyphenyl)-3-(3-sulfanylpropanoyl)-1,3-thiazolidine-4-carboxylic acid

SMILES: C1C(N(C(S1)C2=CC=CC=C2O)C(=O)CCS)C(=O)O

InChIKey: BSHDUMDXSRLRBI-JOYOIKCWSA-N

InChI: InChI=1S/C13H15NO4S2/c15-10-4-2-1-3-8(10)12-14(11(16)5-6-19)9(7-20-12)13(17)18/h1-4,9,12,15,19H,5-7H2,(H,17,18)/t9-,12+/m0/s1

Synonyms: BRN 5762860 | (2R,4R)-2-(2-hydroxyphenyl)-3-(3-sulfanylpropanoyl)-1,3-thiazolidine-4-carboxylic acid | 4-Thiazolidine...
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S-777469
- ≥98%
Cas Number: 885496-53-7 Compound CID: 57331749

Formula: C₂₃H₂₇FN₂O₄ Molecular Weight: 414.47

IUPAC Name: 1-[[6-ethyl-1-[(4-fluorophenyl)methyl]-5-methyl-2-oxopyridine-3-carbonyl]amino]cyclohexane-1-carboxylic acid

SMILES: CCC1=C(C=C(C(=O)N1CC2=CC=C(C=C2)F)C(=O)NC3(CCCCC3)C(=O)O)C

InChIKey: JIYXOJFSPOFZPY-UHFFFAOYSA-N

InChI: InChI=1S/C23H27FN2O4/c1-3-19-15(2)13-18(20(27)25-23(22(29)30)11-5-4-6-12-23)21(28)26(19)14-16-7-9-17(24)10-8-16/h7-10,13H,3-6,11-12,14H2,1-2H3,(H,25,2show more

Synonyms: S-777469 | BDBM50380892 | UNII-88NI79737I | Q27269944 | 885496-53-7 | HY-145153 | DTXSID301336647 | 88NI79737I | MS-2...
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(6S)-4-oxo-5-azaspiro[2.4]heptane-6-carboxylic acid
- ≥97%
Cas Number: 2102412-77-9 Compound CID: 129605395

Formula: C₇H₉NO₃ Molecular Weight: 155.15

IUPAC Name: (6S)-4-oxo-5-azaspiro[2.4]heptane-6-carboxylic acid

SMILES: C1CC12CC(NC2=O)C(=O)O

InChIKey: LFYFIPUSMXSACI-BYPYZUCNSA-N

InChI: InChI=1S/C7H9NO3/c9-5(10)4-3-7(1-2-7)6(11)8-4/h4H,1-3H2,(H,8,11)(H,9,10)/t4-/m0/s1

Synonyms: 5-Azaspiro[2.4]heptane-6-carboxylic acid, 4-oxo-, (6S)- | MFCD30749396 | P17404 | (6S)-4-oxo-5-azaspiro[2.4]heptane-6...
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(2R)-2-acetamido-3-[[2-amino-9-[(4-fluorophenyl)methyl]-6-oxo-1H-purin-8-yl]sulfanyl]propanoic acid
- ≥97%
Cas Number: 2241669-86-1 Compound CID: 142409041

Formula: C₁₇H₁₇N₆O₄FS Molecular Weight: 420.42

IUPAC Name: (2R)-2-acetamido-3-[[2-amino-9-[(4-fluorophenyl)methyl]-6-oxo-1H-purin-8-yl]sulfanyl]propanoic acid

SMILES: CC(=O)NC(CSC1=NC2=C(N1CC3=CC=C(C=C3)F)N=C(NC2=O)N)C(=O)O

InChIKey: DWTZTMSSTASBNX-NSHDSACASA-N

InChI: InChI=1S/C17H17FN6O4S/c1-8(25)20-11(15(27)28)7-29-17-21-12-13(22-16(19)23-14(12)26)24(17)6-9-2-4-10(18)5-3-9/h2-5,11H,6-7H2,1H3,(H,20,25)(H,27,28)(H3,show more

Synonyms: 2241669-86-1 | N-Acetyl-S-(2-amino-9-(4-fluorobenzyl)-6-oxo-6,9-dihydro-1H-purin-8-yl)-L-cysteine | SCHEMBL21977457 |...
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(3S)-7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3,8-dicarboxylic acid
- ≥97%
Cas Number: 1445865-55-3 Compound CID: 118106218

Formula: C₁₀H₉NO₆ Molecular Weight: 239.18

IUPAC Name: (3S)-7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3,8-dicarboxylic acid

SMILES: C1CC2=C(C(=CC(=O)N2C1C(=O)O)O)C(=O)O

InChIKey: HUFICPZUGMCVGN-YFKPBYRVSA-N

InChI: InChI=1S/C10H9NO6/c12-6-3-7(13)11-4(8(6)10(16)17)1-2-5(11)9(14)15/h3,5,12H,1-2H2,(H,14,15)(H,16,17)/t5-/m0/s1

Synonyms: 1445865-55-3 | (3S)-7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3,8-dicarboxylic acid | 3,8-Indolizinedicarboxylic acid...
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(2R)-1-(2-methylprop-2-enoyl)pyrrolidine-2-carboxylic acid
- ≥97%
Cas Number: 106089-24-1 Compound CID: 11615290

Formula: C₉H₁₃NO₃ Molecular Weight: 183.2

IUPAC Name: (2R)-1-(2-methylprop-2-enoyl)pyrrolidine-2-carboxylic acid

SMILES: CC(=C)C(=O)N1CCCC1C(=O)O

InChIKey: SJAYUJDJZUWFDO-SSDOTTSWSA-N

InChI: InChI=1S/C9H13NO3/c1-6(2)8(11)10-5-3-4-7(10)9(12)13/h7H,1,3-5H2,2H3,(H,12,13)/t7-/m1/s1

Synonyms: A1-02205 | BS-42797 | (2R)-1-(2-Methylacryloyl)pyrrolidine-2-carboxylic acid | (2R)-1-Methacryloylpyrrolidin-2-carbox...
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[³H]meclinertant
IUPAC Name: 2-[[5-[2,6-bis(tritritiomethoxy)phenyl]-1-(7-chloroquinolin-4-yl)pyrazole-3-carbonyl]amino]adamantane-2-carboxylic acid

SMILES: Clc1ccc2c(c1)nccc2n1nc(cc1c1c(cccc1OC([3H])([3H])[3H])OC([3H])([3H])[3H])C(=O)NC1(C(=O)O)C2CC3CC1CC(C2)C3

InChIKey: DYLJVOXRWLXDIG-VQBNBCTGSA-N

InChI: InChI=1S/C32H31ClN4O5/c1-41-27-4-3-5-28(42-2)29(27)26-16-24(36-37(26)25-8-9-34-23-15-21(33)6-7-22(23)25)30(38)35-32(31(39)40)19-11-17-10-18(13-19)14-2show more

Synonyms: [³H]-SR48692;[³H]reminertant;[³H]SR-48692
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kelatorphan
Cas Number: 92175-57-0 Compound CID: 123982

IUPAC Name: (2S)-2-[[(2R)-2-benzyl-4-(hydroxyamino)-4-oxobutanoyl]amino]propanoic acid

SMILES: CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CC(=O)NO

InChIKey: OJCFZTVYDSKXNM-GXSJLCMTSA-N

InChI: InChI=1S/C14H18N2O5/c1-9(14(19)20)15-13(18)11(8-12(17)16-21)7-10-5-3-2-4-6-10/h2-6,9,11,21H,7-8H2,1H3,(H,15,18)(H,16,17)(H,19,20)/t9-,11+/m0/s1

Synonyms: n-[(2r)-2-benzyl-4-(hydroxyamino)-4-oxobutanoyl]-l-alanine | KEL | (2S)-2-[[(2R)-2-benzyl-4-(hydroxyamino)-4-oxobutan...
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