激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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CI 1020,ETA拮抗剂
- ≥98%(HPLC)
CAS号 : 162256-50-0 Compound CID : 9870830

分子式: C₂₈H₂₆O₉ 分子量: 506.5

IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[(3,4,5-trimethoxyphenyl)methyl]furan-2-one

SMILES: COC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC(=C(C(=C5)OC)OC)OC)O

InChIKey: PWIPORDFWDZCJG-UHFFFAOYSA-N

InChI: InChI=1S/C28H26O9/c1-31-19-8-6-18(7-9-19)28(30)20(11-16-12-23(32-2)26(34-4)24(13-16)33-3)25(27(29)37-28)17-5-10-21-22(14-17)36-15-35-21/h5-10,12-14,30H,11,15H2,1-4H3
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A 127722,ETA拮抗剂
- ≥98%(HPLC)
CAS号 : 195704-72-4 Compound CID : 159594

分子式: C₂₉H₃₈N₂O₆ 分子量: 510.62

IUPAC Name: (2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid

SMILES: CCCCN(CCCC)C(=O)CN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)O)C3=CC4=C(C=C3)OCO4

InChIKey: MOTJMGVDPWRKOC-QPVYNBJUSA-N

InChI: InChI=1S/C29H38N2O6/c1-4-6-14-30(15-7-5-2)26(32)18-31-17-23(21-10-13-24-25(16-21)37-19-36-24)27(29(33)34)28(31)20-8-11-22(35-3)12-9-20/h8-13,16,23,27-28H,4-7,14-15,17-19H2,1-3H3,(H,33,34)/t23-,27-,28+/m1/s1
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Macitentan (ACT 064992)
- 10mM in DMSO
CAS号 : 441798-33-0(DMSO)

分子式: C₁₉H₂₀Br₂N₆O₄S 分子量: 588.27

SMILES: CCCN[S](=O)(=O)NC1=NC=NC(=C1C2=CC=C(Br)C=C2)OCCOC3=NC=C(Br)C=N3
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Zibotentan (ZD4054)
- 10mM in DMSO
CAS号 : 186497-07-4(DMSO)

分子式: C₁₉H₁₆N₆O₄S 分子量: 424.43

SMILES: COC1=NC(=CN=C1N[S](=O)(=O)C2=CC=CN=C2C3=CC=C(C=C3)C4=NN=CO4)C
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安贝生坦
- 10mM in DMSO
CAS号 : 177036-94-1(DMSO)

分子式: C₂₂H₂₂N₂O₄ 分子量: 378.42

SMILES: COC(C(OC1=NC(=CC(=N1)C)C)C(O)=O)(C2=CC=CC=C2)C3=CC=CC=C3
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甘草次酸(β型）
- 10mM in DMSO
CAS号 : 471-53-4(DMSO)

分子式: C₃₀H₄₆O₄ 分子量: 470.68

SMILES: CC1(C)C(O)CCC2(C)C1CCC3(C)C2C(=O)C=C4C5CC(C)(CCC5(C)CCC34C)C(O)=O
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BVT-14225
CAS号 : 376638-65-2 Compound CID : 6918663

分子式: C₁₆H₂₀ClN₃O₃S₂ 分子量: 401.9

IUPAC Name: 2-[2-[(3-chloro-2-methylphenyl)sulfonylamino]-1,3-thiazol-4-yl]-N,N-diethylacetamide

SMILES: CCN(CC)C(=O)CC1=CSC(=N1)NS(=O)(=O)C2=C(C(=CC=C2)Cl)C

InChIKey: PNFMZAHWOASGJC-UHFFFAOYSA-N

InChI: InChI=1S/C16H20ClN3O3S2/c1-4-20(5-2)15(21)9-12-10-24-16(18-12)19-25(22,23)14-8-6-7-13(17)11(14)3/h6-8,10H,4-5,9H2,1-3H3,(H,18,19)

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BQ-123
- 10mM in DMSO
CAS号 : 136553-81-6 Compound CID : 443289

分子式: C₃₁H₄₂N₆O₇ 分子量: 610.7

IUPAC Name: 2-[(3R,6R,9S,12R,15S)-6-(1H-indol-3-ylmethyl)-9-(2-methylpropyl)-2,5,8,11,14-pentaoxo-12-propan-2-yl-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetic acid

SMILES: CC(C)CC1C(=O)NC(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N1)C(C)C)CC(=O)O)CC3=CNC4=CC=CC=C43

InChIKey: VYCMAAOURFJIHD-PJNXIOHISA-N

InChI: InChI=1S/C31H42N6O7/c1-16(2)12-21-27(40)33-22(13-18-15-32-20-9-6-5-8-19(18)20)28(41)35-23(14-25(38)39)31(44)37-11-7-10-24(37)29(42)36-26(17(3)4)30(43)34-21/h5-6,8-9,15-17,21-24,26,32H,7,10-14H2,1-4H3,(H,33,40)(H,34,43)(H,35,41)(H,36,42)(H,38,39)/t21-,22+,23+,24-,26+/m0/s1
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WAY-604429
- 10mM in DMSO
CAS号 : 453526-02-8 Compound CID : 3146235

分子式: C₂₅H₂₀N₄OS 分子量: 424.52

IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanone

SMILES: C1CN(C2=CC=CC=C21)C(=O)CSC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChIKey: VYWVGJDFMVEDFJ-UHFFFAOYSA-N

InChI: InChI=1S/C25H20N4OS/c30-22(29-16-15-18-9-7-8-14-21(18)29)17-31-25-26-23(19-10-3-1-4-11-19)24(27-28-25)20-12-5-2-6-13-20/h1-14H,15-17H2
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科罗索酸
- 10mM in DMSO
CAS号 : 4547-24-4(DMSO) Compound CID : 6918774

分子式: C₃₀H₄₈O₄ 分子量: 472.70

IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid

SMILES: CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O

InChIKey: HFGSQOYIOKBQOW-ZSDYHTTISA-N

InChI: InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1
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1,5-Bis(4-hydroxyphenyl)penta-1,4-dien-3-one
CAS号 : 3654-49-7 Compound CID : 6437306

分子式: C₁₇H₁₄O₃ 分子量: 266.29

IUPAC Name: (1E,4E)-1,5-bis(4-hydroxyphenyl)penta-1,4-dien-3-one

SMILES: C1=CC(=CC=C1C=CC(=O)C=CC2=CC=C(C=C2)O)O

InChIKey: FTEGUKWEUQPKIS-YDWXAUTNSA-N

InChI: InChI=1S/C17H14O3/c18-15-7-1-13(2-8-15)5-11-17(20)12-6-14-3-9-16(19)10-4-14/h1-12,18-19H/b11-5+,12-6+

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1-(4-Chlorophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone
CAS号 : 307343-39-1 Compound CID : 686457

分子式: C₁₁H₉ClN₂OS₂ 分子量: 284.8

IUPAC Name: 1-(4-chlorophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

SMILES: CC1=NN=C(S1)SCC(=O)C2=CC=C(C=C2)Cl

InChIKey: AWMRCOYYVOFYGS-UHFFFAOYSA-N

InChI: InChI=1S/C11H9ClN2OS2/c1-7-13-14-11(17-7)16-6-10(15)8-2-4-9(12)5-3-8/h2-5H,6H2,1H3

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