激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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醋酸氢化可的松
- ≥98%
CAS号 : 50-03-3 Compound CID : 5744

分子式: C₂₃H₃₂O₆ 分子量: 404.5

IUPAC Name: [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

SMILES: CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)O

InChIKey: ALEXXDVDDISNDU-JZYPGELDSA-N

InChI: InChI=1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1
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4-孕烯-3,11,20-三酮
- ≥97%
CAS号 : 516-15-4 Compound CID : 94166

分子式: C₂₁H₂₈O₃ 分子量: 328.456

IUPAC Name: (8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione

SMILES: CC(=O)C1CCC2C1(CC(=O)C3C2CCC4=CC(=O)CCC34C)C

InChIKey: WKAVAGKRWFGIEA-DADBAOPHSA-N

InChI: InChI=1S/C21H28O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h10,15-17,19H,4-9,11H2,1-3H3/t15-,16+,17-,19+,20-,21+/m0/s1
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醛甾酮标准液
- 100 μg/mL in acetonitrile
CAS号 : 52-39-1 Compound CID : 5839

分子式: C₂₁H₂₈O₅ 分子量: 360.44

IUPAC Name: (8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carbaldehyde

SMILES: CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4C(=O)CO)C=O)O

InChIKey: PQSUYGKTWSAVDQ-ZVIOFETBSA-N

InChI: InChI=1S/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20-,21+/m0/s1
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GSK503,EZH2甲基转移酶抑制剂
- ≥98%
CAS号 : 1346572-63-1 Compound CID : 67469117

分子式: C₃₁H₃₈N₆O₂ 分子量: 526.67

IUPAC Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-methyl-6-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-1-propan-2-ylindole-4-carboxamide

SMILES: CC1=CC(=C(C(=O)N1)CNC(=O)C2=C3C(=CN(C3=CC(=C2)C4=CN=C(C=C4)N5CCN(CC5)C)C(C)C)C)C

InChIKey: HRDQQHUKUIKFHT-UHFFFAOYSA-N

InChI: InChI=1S/C31H38N6O2/c1-19(2)37-18-21(4)29-25(30(38)33-17-26-20(3)13-22(5)34-31(26)39)14-24(15-27(29)37)23-7-8-28(32-16-23)36-11-9-35(6)10-12-36/h7-8,13-16,18-19H,9-12,17H2,1-6H3,(H,33,38)(H,34,39)
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泼尼松龙
- ≥98%
CAS号 : 50-24-8 Compound CID : 5755

分子式: C₂₁H₂₈O₅ 分子量: 360.44

IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one

SMILES: CC12CC(C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)C=CC34C)O

InChIKey: OIGNJSKKLXVSLS-VWUMJDOOSA-N

InChI: InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
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Lirametostat (CPI-1205)
- 10mM in DMSO
CAS号 : 1621862-70-1(DMSO)

分子式: C₂₇H₃₃F₃N₄O₃ 分子量: 518.57

SMILES: COC1=C(CNC(=O)C2=C(C)[N](C(C)C3CCN(CC3)CC(F)(F)F)C4=C2C=CC=C4)C(=O)NC(=C1)C
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GSK126
- 2mM in DMSO
CAS号 : 1346574-57-9(DMSO)

分子式: C₃₁H₃₈N₆O₂ 分子量: 526.67

SMILES: CCC(C)[N]1C=C(C)C2=C(C=C(C=C12)C3=CC=C(N=C3)N4CCNCC4)C(=O)NCC5=C(C)C=C(C)NC5=O
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Tazemetostat (EPZ-6438)
- in 2mM DMSO
CAS号 : 1403254-99-8(DMSO)

分子式: C₃₄H₄₄N₄O₄ 分子量: 572.74

SMILES: CCN(C1CCOCC1)C2=C(C)C(=CC(=C2)C3=CC=C(CN4CCOCC4)C=C3)C(=O)NCC5=C(C)C=C(C)NC5=O
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氢化可的松
- 10mM in DMSO
CAS号 : 50-23-7(DMSO)

分子式: C₂₁H₃₀O₅ 分子量: 362.46

SMILES: CC12CCC(=O)C=C1CCC3C4CCC(O)(C(=O)CO)C4(C)CC(O)C23
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泼尼松龙
- 10mM in DMSO
CAS号 : 50-24-8(DMSO)

分子式: C₂₁H₂₈O₅ 分子量: 360.44

SMILES: CC12CC(O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(=O)CO
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黄体酮
- 10mM in DMSO
CAS号 : 57-83-0(DMSO)

分子式: C₂₁H₃₀O₂ 分子量: 314.46

SMILES: CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
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CPI-360
- ≥98%
CAS号 : 1802175-06-9 Compound CID : 73442743

分子式: C₂₅H₃₁N₃O₄ 分子量: 437.53

IUPAC Name: N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-(oxan-4-yl)ethyl]indole-3-carboxamide

SMILES: CC1=CC(=C(C(=O)N1)CNC(=O)C2=C(N(C3=CC=CC=C32)C(C)C4CCOCC4)C)OC

InChIKey: PFPSFENQCNMITC-MRXNPFEDSA-N

InChI: InChI=1S/C25H31N3O4/c1-15-13-22(31-4)20(24(29)27-15)14-26-25(30)23-17(3)28(21-8-6-5-7-19(21)23)16(2)18-9-11-32-12-10-18/h5-8,13,16,18H,9-12,14H2,1-4H3,(H,26,30)(H,27,29)/t16-/m1/s1
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