N-acyl-alpha amino acids and derivatives

(2R)-1-(2-methylprop-2-enoyl)pyrrolidine-2-carboxylic acid

Grade & Purity:

≥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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fasidotril

Grade & Purity:

Moligand™

Cas Number: 135038-57-2 Compound CID: 5311337

IUPAC Name: phenylmethyl (2S)-2-[[(2S)-2-(acetylsulfanylmethyl)-3-(1,3-benzodioxol-5-yl)propanoyl]amino]propanoate

SMILES: CC(=O)SC[C@H](C(=O)N[C@H](C(=O)OCc1ccccc1)C)Cc1ccc2c(c1)OCO2

InChIKey: KKBIUAUSZKGNOA-HNAYVOBHSA-N

InChI: InChI=1S/C23H25NO6S/c1-15(23(27)28-12-17-6-4-3-5-7-17)24-22(26)19(13-31-16(2)25)10-18-8-9-20-21(11-18)30-14-29-20/h3-9,11,15,19H,10,12-14H2,1-2H3,(H,2show more

Synonyms: GTPL6501 | benzyl ((S)-3-(acetylthio)-2-(benzo[d][1,3]dioxol-5-ylmethyl)propanoyl)-L-alaninate | BP1.137 | phenylmeth...

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clometocillin

Grade & Purity:

Moligand™

Cas Number: 1926-49-4 Compound CID: 71807

IUPAC Name: (2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(c1cc(c(cc1)Cl)Cl)OC)C(=O)O)C

InChIKey: JKXQBIZCQJLVOS-GSNLGQFWSA-N

InChI: InChI=1S/C17H18Cl2N2O5S/c1-17(2)12(16(24)25)21-14(23)10(15(21)27-17)20-13(22)11(26-3)7-4-5-8(18)9(19)6-7/h4-6,10-12,15H,1-3H3,(H,20,22)(H,24,25)/t10-,show more

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[³H]meclinertant

Grade & Purity:

Moligand™

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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S-OOPP

Grade & Purity:

Moligand™

IUPAC Name: N-[(3S)-2-oxooxetan-3-yl]-3-phenylpropanamide

SMILES: O=C(N[C@H]1COC1=O)CCc1ccccc1

InChIKey: UUEMOTWYJKOUPP-JTQLQIEISA-N

InChI: InChI=1S/C12H13NO3/c14-11(13-10-8-16-12(10)15)7-6-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,14)/t10-/m0/s1

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PSB-6426

Grade & Purity:

Moligand™

IUPAC Name: (2S,3S,4R,5R)-N-[2-[4-(diethoxyphosphorylmethyl)anilino]-2-oxoethyl]-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolane-2-carboxamide

SMILES: CCOP(=O)(Cc1ccc(cc1)NC(=O)CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O)OCC

InChIKey: AEVBPXDFDKBGLT-YOUFYPILSA-N

InChI: InChI=1S/C22H29N4O10P/c1-3-34-37(33,35-4-2)12-13-5-7-14(8-6-13)24-16(28)11-23-20(31)19-17(29)18(30)21(36-19)26-10-9-15(27)25-22(26)32/h5-10,17-19,21,2show more

Synonyms: compound 19a

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KC-12615

Grade & Purity:

Moligand™

IUPAC Name: (2R)-2-[[1-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]carbamoyl]cyclopentyl]methyl]-4-phenylbutanoic acid

SMILES: OC(=O)CN1C(=O)[C@H](CCc2c1cccc2)NC(=O)C1(CCCC1)C[C@H](C(=O)O)CCc1ccccc1

InChIKey: RSRHEOWMSRYTNB-PKTZIBPZSA-N

InChI: InChI=1S/C29H34N2O6/c32-25(33)19-31-24-11-5-4-10-21(24)14-15-23(26(31)34)30-28(37)29(16-6-7-17-29)18-22(27(35)36)13-12-20-8-2-1-3-9-20/h1-5,8-11,22-23show more

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ubrogepant

Grade & Purity:

Moligand™

Cas Number: 1374248-77-7 Compound CID: 68748835

Formula: C₂₉H₂₆F₃N₅O₃ Molecular Weight: 549.5

IUPAC Name: (3S)-N-[(3S,5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pshow more

SMILES: CC1C(CC(C(=O)N1CC(F)(F)F)NC(=O)C2=CC3=C(CC4(C3)C5=C(NC4=O)N=CC=C5)N=C2)C6=CC=CC=C6

InChIKey: DDOOFTLHJSMHLN-ZQHRPCGSSA-N

InChI: InChI=1S/C29H26F3N5O3/c1-16-20(17-6-3-2-4-7-17)11-22(26(39)37(16)15-29(30,31)32)35-25(38)19-10-18-12-28(13-23(18)34-14-19)21-8-5-9-33-24(21)36-27(28)4show more

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sulbenicillin

Grade & Purity:

Moligand™

Cas Number: 41744-40-5 EC Number: 255-528-6 Compound CID: 20055036

IUPAC Name: (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-2-phenyl-2-sulfoacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)C(=O)O)C

InChIKey: JETQIUPBHQNHNZ-NJBDSQKTSA-N

InChI: InChI=1S/C16H18N2O7S2/c1-16(2)11(15(21)22)18-13(20)9(14(18)26-16)17-12(19)10(27(23,24)25)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,17,19)(H,21,22)(H,23,24,show more

Synonyms: Sulbenicillinum [INN-Latin] | Sulbenicilline [INN-French] | (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-((R,S)-2-phenyl-2-sulfoac...

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pranazepide

Grade & Purity:

Moligand™

Cas Number: 150408-73-4 Compound CID: 132916

IUPAC Name: N-[(11S)-9-(2-fluorophenyl)-12-oxo-1,10-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7,9-tetraen-11-yl]-1H-indole-2-carboxamide

SMILES: C1CN2C(=O)C(N=C(C3=CC=CC1=C32)C4=CC=CC=C4F)NC(=O)C5=CC6=CC=CC=C6N5

InChIKey: WKJDXKWFGJWGAS-XMMPIXPASA-N

InChI: InChI=1S/C26H19FN4O2/c27-19-10-3-2-8-17(19)22-18-9-5-7-15-12-13-31(23(15)18)26(33)24(29-22)30-25(32)21-14-16-6-1-4-11-20(16)28-21/h1-11,14,24,28H,12-1show more

Synonyms: Q27088440 | 5-ethyl-5-(pentan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione | Pranazepide | (-)-N-((S)-1-(o-Fluorophenyl)-3,...

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kelatorphan

Grade & Purity:

Moligand™

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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latamoxef

Grade & Purity:

Moligand™

Cas Number: 64952-97-2 Compound CID: 47499

Formula: C₂₀H₂₀N₆O₉S Molecular Weight: 520.48

IUPAC Name: (6R,7R)-7-[[2-carboxy-2-(4-hydroxyphenyl)acetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-show more

SMILES: CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NC(=O)C(C4=CC=C(C=C4)O)C(=O)O)OC)OC2)C(=O)O

InChIKey: JWCSIUVGFCSJCK-CAVRMKNVSA-N

InChI: InChI=1S/C20H20N6O9S/c1-25-19(22-23-24-25)36-8-10-7-35-18-20(34-2,17(33)26(18)13(10)16(31)32)21-14(28)12(15(29)30)9-3-5-11(27)6-4-9/h3-6,12,18,27H,7-8show more

Synonyms: (6R,7R)-7-[[3-hydroxy-2-(4-hydroxyphenyl)-3-oxo-propanoyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-...

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N-acyl-alpha amino acids and derivatives

Description:

Ancestors: