按“信号通路”分类 - 小分子和化合物库

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γ-氨基丁酸（GABA）
- ≥99%
CAS号: 56-12-2 EC号: 200-258-6

分子式: C₄H₉NO₂ 分子量: 103.12

IUPAC Name: 4-aminobutanoic acid

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

InChIKey: BTCSSZJGUNDROE-UHFFFAOYSA-N

InChI: 1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
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普乐沙福
- ≥98%
CAS号: 110078-46-1

分子式: C₂₈H₅₄N₈ 分子量: 502.78

IUPAC Name: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane

SMILES: C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CN3CCCNCCNCCCNCC3

InChIKey: YIQPUIGJQJDJOS-UHFFFAOYSA-N

InChI: 1S/C28H54N8/c1-9-29-15-17-31-13-3-21-35(23-19-33-11-1)25-27-5-7-28(8-6-27)26-36-22-4-14-32-18-16-30-10-2-12-34-20-24-36/h5-8,29-34H,1-4,9-26H2
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巴氯酚
- ≥98%
CAS号: 1134-47-0 EC号: 214-486-9

分子式: C₁₀H₁₂ClNO₂ 分子量: 213.66

IUPAC Name: 4-amino-3-(4-chlorophenyl)butanoic acid

SMILES: C1=CC(=CC=C1C(CC(=O)O)CN)Cl

InChIKey: KPYSYYIEGFHWSV-UHFFFAOYSA-N

InChI: 1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)
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(R)-巴氯芬
- ≥98%
CAS号: 69308-37-8 EC号: 641-399-7

分子式: C₁₀H₁₂ClNO₂ 分子量: 213.66

IUPAC Name: (3R)-4-amino-3-(4-chlorophenyl)butanoic acid

SMILES: C1=CC(=CC=C1C(CC(=O)O)CN)Cl

InChIKey: KPYSYYIEGFHWSV-QMMMGPOBSA-N

InChI: 1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1
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钙离子载体 A23187
- ≥97%
CAS号: 52665-69-7

分子式: C₂₉H₃₇N₃O₆ 分子量: 523.62

IUPAC Name: 5-(methylamino)-2-[[(2S,3R,5R,6S,8R,9R)-3,5,9-trimethyl-2-[(2S)-1-oxo-1-(1H-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-1,3-benzoxazole-4-carboxylic acid

SMILES: CC1CCC2(C(CC(C(O2)C(C)C(=O)C3=CC=CN3)C)C)OC1CC4=NC5=C(O4)C=CC(=C5C(=O)O)NC

InChIKey: HIYAVKIYRIFSCZ-CYEMHPAKSA-N

InChI: 1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16-See more
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INCB3344
- ≥98%
CAS号: 1262238-11-8

分子式: C₂₉H₃₄F₃N₃O₆ 分子量: 577.59

IUPAC Name: N-[2-[[(3S,4S)-1-[4-(1,3-benzodioxol-5-yl)-4-hydroxycyclohexyl]-4-ethoxypyrrolidin-3-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide

SMILES: CCOC1CN(CC1NC(=O)CNC(=O)C2=CC(=CC=C2)C(F)(F)F)C3CCC(CC3)(C4=CC5=C(C=C4)OCO5)O

InChIKey: MZEOSVPWMSEFPW-XYCDVDSTSA-N

InChI: 1S/C29H34F3N3O6/c1-2-39-25-16-35(21-8-10-28(38,11-9-21)19-6-7-23-24(13-19)41-17-40-23)15-22(25)34-26(36)14-33-27(37)18-4-3-5-20(12-18)29(30,31)32/h3-7,12-13,21-22,25,38H,2,8-11,14-17H2,1H3,(H,33,37)(HSee more
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RS504393,CCR2趋化因子受体拮抗剂
- ≥98%(HPLC)
CAS号: 300816-15-3 Compound CID : 9953769

分子式: C₂₅H₂₇N₃O₃ 分子量: 417.5

IUPAC Name: 6-methyl-1'-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethyl]spiro[1H-3,1-benzoxazine-4,4'-piperidine]-2-one

SMILES: CC1=CC2=C(C=C1)NC(=O)OC23CCN(CC3)CCC4=C(OC(=N4)C5=CC=CC=C5)C

InChIKey: ODNICNWASXKNNQ-UHFFFAOYSA-N

InChI: 1S/C25H27N3O3/c1-17-8-9-22-20(16-17)25(31-24(29)27-22)11-14-28(15-12-25)13-10-21-18(2)30-23(26-21)19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3,(H,27,29)
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西尼昔洛韦
- ≥97%
CAS号: 497223-25-3

分子式: C₄₁H₅₂N₄O₄S 分子量: 696.95

IUPAC Name: (5E)-8-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-N-[4-[(S)-(3-propylimidazol-4-yl)methylsulfinyl]phenyl]-3,4-dihydro-2H-1-benzazocine-5-carboxamide

SMILES: CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCCC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)CC5=CN=CN5CCC)CC(C)C

InChIKey: PNDKCRDVVKJPKG-WHERJAGFSA-N

InChI: 1S/C41H52N4O4S/c1-5-7-22-48-23-24-49-38-15-10-32(11-16-38)33-12-19-40-35(25-33)26-34(9-8-21-44(40)28-31(3)4)41(46)43-36-13-17-39(18-14-36)50(47)29-37-27-42-30-45(37)20-6-2/h10-19,25-27,30-31H,5-9,20-2See more
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3-APPA (CGP 27492)
- 100 mM/ml
CAS号: 103680-47-3 Compound CID : 6335948

分子式: C₃H₁₀NO₂P 分子量: 123.09

IUPAC Name: 3-aminopropyl-hydroxy-oxophosphanium

SMILES: C(CN)C[P+](=O)O

InChIKey: MQIWYGZSHIXQIU-UHFFFAOYSA-O

InChI: 1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2/p+1
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GS 39783
- ≥99%
CAS号: 39069-52-8

分子式: C₁₅H₂₃N₅O₂S 分子量: 337.44

IUPAC Name: 4-N,6-N-dicyclopentyl-2-methylsulfanyl-5-nitropyrimidine-4,6-diamine

SMILES: CSC1=NC(=C(C(=N1)NC2CCCC2)[N+](=O)[O-])NC3CCCC3

InChIKey: GSGVDKOCBKBMGG-UHFFFAOYSA-N

InChI: 1S/C15H23N5O2S/c1-23-15-18-13(16-10-6-2-3-7-10)12(20(21)22)14(19-15)17-11-8-4-5-9-11/h10-11H,2-9H2,1H3,(H2,16,17,18,19)
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GABA,抑制性神经递质
- 100mM in H2O
CAS号: 56-12-2 EC号: 200-258-6

分子式: C₄H₉NO₂ 分子量: 103.12

IUPAC Name: 4-aminobutanoic acid

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

InChIKey: BTCSSZJGUNDROE-UHFFFAOYSA-N

InChI: 1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
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CGP 7930,阳性GABA B受体变构调节剂
- ≥98%
CAS号: 57717-80-3

分子式: C₁₉H₃₂O₂ 分子量: 292.46

IUPAC Name: 2,6-ditert-butyl-4-(3-hydroxy-2,2-dimethylpropyl)phenol

SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C)(C)CO

InChIKey: XLWJPQQFJNGUPA-UHFFFAOYSA-N

InChI: 1S/C19H32O2/c1-17(2,3)14-9-13(11-19(7,8)12-20)10-15(16(14)21)18(4,5)6/h9-10,20-21H,11-12H2,1-8H3
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