(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(3R,6S,9S,12S,15S,18S)-18-acetamido-6,15-bis(3-amino-3-oxopropyl)-12-[(1R)-1-hydroxyethyl]-9-(1H-indol-3-ylmethyl)-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentazacycloicosane-3-carbonyl]amino]-3-[4-(2-aminoethoxy)phenyl]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-amino-2-methylhexanoyl]amino]-5-[[(2S)-4-amino-1-[(2-amino-2-oxoethyl)amino]-1,4-dioxobutan-2-yl]amino]-5-oxopentanoic acid

• 常用名: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(3R,6S,9S,12S,15S,18S)-18-acetamido-6,15-bis(3-amino-3-oxopropyl)-12-[(1R)-1-hydroxyethyl]-9-(1H-indol-3-ylmethyl)-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentazacycloicosane-3-carbonyl]amino]-3-[4-(2-aminoethoxy)phenyl]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-amino-2-methylhexanoyl]amino]-5-[[(2S)-4-amino-1-[(2-amino-2-oxoethyl)amino]-1,4-dioxobutan-2-yl]amino]-5-oxopentanoic acid
• 英文名: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(3R,6S,9S,12S,15S,18S)-18-acetamido-6,15-bis(3-amino-3-oxopropyl)-12-[(1R)-1-hydroxyethyl]-9-(1H-indol-3-ylmethyl)-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentazacycloicosane-3-carbonyl]amino]-3-[4-(2-aminoethoxy)phenyl]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-amino-2-methylhexanoyl]amino]-5-[[(2S)-4-amino-1-[(2-amino-2-oxoethyl)amino]-1,4-dioxobutan-2-yl]amino]-5-oxopentanoic acid
• CAS号: 1865708-69-5
• 分子量: 1623.8
• 密度: N/A
• 沸点: N/A
• 分子式: C₇₄H₁₀₂N₂₀O₂₀S
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(3R,6S,9S,12S,15S,18S)-18-acetamido-6,15-bis(3-amino-3-oxopropyl)-12-[(1R)-1-hydroxyethyl]-9-(1H-indol-3-ylmethyl)-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentazacycloicosane-3-carbonyl]amino]-3-[4-(2-aminoethoxy)phenyl]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-amino-2-methylhexanoyl]amino]-5-[[(2S)-4-amino-1-[(2-amino-2-oxoethyl)amino]-1,4-dioxobutan-2-yl]amino]-5-oxopentanoic acid

物理化学性质

• 分子式: C₇₄H₁₀₂N₂₀O₂₀S
• 分子量: 1623.8
• InChIKey: YCYOWXTYVQGGHS-XKGNXMRFSA-N
• SMILES: C[C@H]([C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSCC[C@@H](C(=O)N[C@H](C(=O)N1)CCC(=O)N)NC(=O)C)C(=O)N[C@@H](CC2=CC=C(C=C2)OCCN)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@](C)(CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)N)C(=O)NCC(=O)N)CCC(=O)N)CC5=CNC6=CC=CC=C65)O

靶点实验

查看更多实验

实验名称：Inhibition of interleukin-23 binding to human interleukin-23 receptor incubated for 2... 来源：ChEMBL 靶标：Interleukin-23 receptor External Id：CHEMBL4417972

实验名称：Inhibition of interleukin-23 receptor in human DB cells assessed as reduction in IL-2... 来源：ChEMBL 靶标：Interleukin-23 receptor External Id：CHEMBL4417973

实验名称：Inhibition of interleukin-23 binding to rat interleukin-23 receptor incubated for 2 h... 来源：ChEMBL 靶标：N/A External Id：CHEMBL4417974

实验名称：Half life in simulated gastric fluid at 20 uM by LC-MS/MS analysis 来源：ChEMBL 靶标：N/A External Id：CHEMBL4417975

实验名称：Half life in simulated intestinal fluid at 20 uM by LC-MS/MS analysis 来源：ChEMBL 靶标：N/A External Id：CHEMBL4417976

实验名称：Half life in DTT at 50 uM up up to 120 mins by reverse phase HPLC and UV detection ba... 来源：ChEMBL 靶标：N/A External Id：CHEMBL4417977

实验名称：Anti-colitis activity in Sprague-Dawley rat model of TNBS-induced colitis assessed as... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL4418026

实验名称：Binding affinity to recombinant human flag/His-tagged IL-23R (1 to 353 residues) expr... 来源：ChEMBL 靶标：Interleukin-23 receptor External Id：CHEMBL4202302

实验名称：Ratio of IC50 for inhibition of interleukin-23 receptor in rat splenocytes assessed a... 来源：ChEMBL 靶标：N/A External Id：CHEMBL4418027

实验名称：Ratio of IC50 for inhibition of interleukin-23 binding to rat interleukin-23 receptor... 来源：ChEMBL 靶标：N/A External Id：CHEMBL4418028

共32条，当前第1页，共4页

1

2

3

4