Angiotensin-converting Enzyme (ACE) - 代谢酶/蛋白酶 - 按“信号通路”分类 - 小分子和化合物库

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BMS-265246,CDK抑制剂

规格或纯度 :

Moligand™

≥95%

CAS号 : 582315-72-8 Compound CID : 135402864

分子式: C₁₈H₁₇F₂N₃O₂ 分子量: 345.34

IUPAC Name: (4-butoxy-2H-pyrazolo[3,4-b]pyridin-5-yl)-(2,6-difluoro-4-methylphenyl)methanone

SMILES: CCCCOC1=C(C=NC2=NNC=C12)C(=O)C3=C(C=C(C=C3F)C)F

InChIKey: SCFMWQIQBVZOQR-UHFFFAOYSA-N

InChI: InChI=1S/C18H17F2N3O2/c1-3-4-5-25-17-11(8-21-18-12(17)9-22-23-18)16(24)15-13(19)6-10(2)7-14(15)20/h6-9H,3-5H2,1-2H3,(H,21,22,23)

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卡托普利

规格或纯度 :

Moligand™

≥98%

CAS号 : 62571-86-2 Compound CID : 44093

分子式: C₉H₁₅NO₃S 分子量: 217.29

IUPAC Name: (2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

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

InChIKey: FAKRSMQSSFJEIM-RQJHMYQMSA-N

InChI: InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1

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依那普利拉

规格或纯度 :

Moligand™

≥99%

CAS号 : 76420-72-9 Compound CID : 5462501

分子式: C₁₈H₂₈N₂O₇ 分子量: 384.42

IUPAC Name: (2S)-1-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

SMILES: CC(C(=O)N1CCCC1C(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

InChIKey: LZFZMUMEGBBDTC-QEJZJMRPSA-N

InChI: InChI=1S/C18H24N2O5/c1-12(16(21)20-11-5-8-15(20)18(24)25)19-14(17(22)23)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15,19H,5,8-11H2,1H3,(H,22,23)(H,24,25)/t12-,14-,15-/m0/s1

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Perindoprilat

规格或纯度 :

Moligand™

CAS号 : 95153-31-4 Compound CID : 72022

分子式: C₁₇H₂₈N₂O₅ 分子量: 340.41

IUPAC Name: (2S,3aS,7aS)-1-[(2S)-2-[[(1S)-1-carboxybutyl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

SMILES: CCCC(C(=O)O)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O

InChIKey: ODAIHABQVKJNIY-PEDHHIEDSA-N

InChI: InChI=1S/C17H28N2O5/c1-3-6-12(16(21)22)18-10(2)15(20)19-13-8-5-4-7-11(13)9-14(19)17(23)24/h10-14,18H,3-9H2,1-2H3,(H,21,22)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1

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Quinaprilat

规格或纯度 :

Moligand™

CAS号 : 82768-85-2 Compound CID : 107994

分子式: C₂₃H₂₆N₂O₅ 分子量: 410.46

IUPAC Name: (3S)-2-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

SMILES: CC(C(=O)N1CC2=CC=CC=C2CC1C(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

InChIKey: FLSLEGPOVLMJMN-YSSFQJQWSA-N

InChI: InChI=1S/C23H26N2O5/c1-15(24-19(22(27)28)12-11-16-7-3-2-4-8-16)21(26)25-14-18-10-6-5-9-17(18)13-20(25)23(29)30/h2-10,15,19-20,24H,11-14H2,1H3,(H,27,28)(H,29,30)/t15-,19-,20-/m0/s1

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去甲吡啶

规格或纯度 :

Moligand™

≥98%

CAS号 : 131-01-1 Compound CID : 8550

分子式: C₃₂H₃₈N₂O₈ 分子量: 578.65

IUPAC Name: methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

SMILES: COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC

InChIKey: CVBMAZKKCSYWQR-WCGOZPBSSA-N

InChI: InChI=1S/C32H38N2O8/c1-37-24-12-17(13-25(38-2)29(24)39-3)31(35)42-26-14-18-16-34-11-10-20-19-8-6-7-9-22(19)33-28(20)23(34)15-21(18)27(30(26)40-4)32(36)41-5/h6-9,12-13,18,21,23,26-27,30,33H,10-11,14-16H2,1-5H3/t18-,21+,23-,26-,27+,30+/m1/s1

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咪达普利拉

规格或纯度 :

Moligand™

CAS号 : 89371-44-8 Compound CID : 5464344

分子式: C₁₈H₂₃N₃O₆ 分子量: 377.39

IUPAC Name: (4S)-3-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-1-methyl-2-oxoimidazolidine-4-carboxylic acid

SMILES: CC(C(=O)N1C(CN(C1=O)C)C(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

InChIKey: VFAVNRVDTAPBNR-UBHSHLNASA-N

InChI: InChI=1S/C18H23N3O6/c1-11(15(22)21-14(17(25)26)10-20(2)18(21)27)19-13(16(23)24)9-8-12-6-4-3-5-7-12/h3-7,11,13-14,19H,8-10H2,1-2H3,(H,23,24)(H,25,26)/t11-,13-,14-/m0/s1

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培哚普利

规格或纯度 :

Moligand™

≥95%

CAS号 : 82834-16-0 Compound CID : 107807

分子式: C₁₉H₃₂N₂O₅ 分子量: 368.47

IUPAC Name: (2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxopentan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

SMILES: CCCC(C(=O)OCC)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O

InChIKey: IPVQLZZIHOAWMC-QXKUPLGCSA-N

InChI: InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1

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咪达普利

规格或纯度 :

Moligand™

≥97%

CAS号 : 89371-37-9 Compound CID : 5464343

分子式: C₂₀H₂₇N₃O₆ 分子量: 405.4

IUPAC Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-1-methyl-2-oxoimidazolidine-4-carboxylic acid

SMILES: CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2C(CN(C2=O)C)C(=O)O

InChIKey: KLZWOWYOHUKJIG-BPUTZDHNSA-N

InChI: InChI=1S/C20H27N3O6/c1-4-29-19(27)15(11-10-14-8-6-5-7-9-14)21-13(2)17(24)23-16(18(25)26)12-22(3)20(23)28/h5-9,13,15-16,21H,4,10-12H2,1-3H3,(H,25,26)/t13-,15-,16-/m0/s1

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福辛普利

规格或纯度 :

Moligand™

≥95%

CAS号 : 98048-97-6 Compound CID : 55891

分子式: C₃₀H₄₆NO₇P 分子量: 563.67

IUPAC Name: (2S,4S)-4-cyclohexyl-1-[2-[(2-methyl-1-propanoyloxypropoxy)-(4-phenylbutyl)phosphoryl]acetyl]pyrrolidine-2-carboxylic acid

SMILES: CCC(=O)OC(C(C)C)OP(=O)(CCCCC1=CC=CC=C1)CC(=O)N2CC(CC2C(=O)O)C3CCCCC3

InChIKey: BIDNLKIUORFRQP-FKDWWROVSA-N

InChI: InChI=1S/C30H46NO7P/c1-4-28(33)37-30(22(2)3)38-39(36,18-12-11-15-23-13-7-5-8-14-23)21-27(32)31-20-25(19-26(31)29(34)35)24-16-9-6-10-17-24/h5,7-8,13-14,22,24-26,30H,4,6,9-12,15-21H2,1-3H3,(H,34,35)/t25-,26+,30?,39?/m1/s1

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福辛普利拉

规格或纯度 :

Moligand™

≥97%

CAS号 : 95399-71-6 Compound CID : 62956

分子式: C₂₃H₃₄NO₅P 分子量: 435.49

IUPAC Name: (2S,4S)-4-cyclohexyl-1-[2-[hydroxy(4-phenylbutyl)phosphoryl]acetyl]pyrrolidine-2-carboxylic acid

SMILES: C1CCC(CC1)C2CC(N(C2)C(=O)CP(=O)(CCCCC3=CC=CC=C3)O)C(=O)O

InChIKey: WOIWWYDXDVSWAZ-RTWAWAEBSA-N

InChI: InChI=1S/C23H34NO5P/c25-22(17-30(28,29)14-8-7-11-18-9-3-1-4-10-18)24-16-20(15-21(24)23(26)27)19-12-5-2-6-13-19/h1,3-4,9-10,19-21H,2,5-8,11-17H2,(H,26,27)(H,28,29)/t20-,21+/m1/s1

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莫西普利拉

规格或纯度 :

Moligand™

CAS号 : 103775-14-0 Compound CID : 55331

分子式: C₂₅H₃₀N₂O₇ 分子量: 470.51

IUPAC Name: (3S)-2-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

SMILES: CC(C(=O)N1CC2=CC(=C(C=C2CC1C(=O)O)OC)OC)NC(CCC3=CC=CC=C3)C(=O)O

InChIKey: CMPAGYDKASJORH-YSSFQJQWSA-N

InChI: InChI=1S/C25H30N2O7/c1-15(26-19(24(29)30)10-9-16-7-5-4-6-8-16)23(28)27-14-18-13-22(34-3)21(33-2)12-17(18)11-20(27)25(31)32/h4-8,12-13,15,19-20,26H,9-11,14H2,1-3H3,(H,29,30)(H,31,32)/t15-,19-,20-/m0/s1

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