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SM-164 - 98%, high purity , CAS No.957135-43-2
XIAP Selective Inhibitors | Antagonists
Basic Description Synonyms AC-35485 | SM164 | SM-164 | MS-31985 | SCHEMBL9973411 | (3S,6S,10aS)-N-[(S)-(1-{4-[4-(4-{4-[(S)-{[(3S,6S,10aS)-6-[(2S)-2-(methylamino)propanamido]-5-oxo-decahydropyrrolo[1,2-a]azocin-3-yl]formamido}(phenyl)methyl]-1H-1,2,3-triazol-1-yl}butyl)phenyl]butyl} Specifications & Purity ≥98% Biochemical and Physiological Mechanisms SM-164 is a potent, non-peptide, cell-permeable antagonist of XIAP that targets both the BIR2 and BIR3 domains with IC50 of 1.39 nM. SM-164 induces apoptosis and tumor regression. Storage Temp Store at -20°C Shipped In Ice chest + Ice pads
Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens Tyrosine-protein kinase ABL inhibitor INHIBITOR ALA1862 Tyrosine-protein kinase ABL SINGLE PROTEIN Homo sapiens
Names and Identifiers IUPAC Name (3S,6S,10aS)-N-[(S)-[1-[4-[4-[4-[4-[(S)-[[(3S,6S,10aS)-6-[[(2S)-2-(methylamino)propanoyl]amino]-5-oxo-2,3,6,7,8,9,10,10a-octahydro-1H-pyrrolo[1,2-a]azocine-3-carbonyl]amino]-phenylmethyl]triazol-1-yl]butyl]phenyl]butyl]triazol-4-yl]-phenylmethyl]-6-[[(2S)-2-(methylamino)propanoyl]amino]-5-oxo-2,3,6,7,8,9,10,10a-octahydro-1H-pyrrolo[1,2-a]azocine-3-carboxamide INCHI InChI=1S/C62H84N14O6/c1-41(63-3)57(77)65-49-27-13-11-25-47-33-35-53(75(47)61(49)81)59(79)67-55(45-21-7-5-8-22-45)51-39-73(71-69-51)37-17-15-19-43-29-31-44(32-30-43)20-16-18-38-74-40-52(70-72-74)56(46-23-9-6-10-24-46)68-60(80)54-36-34-48-26-12-14-28-50(62(82)76(48)54)66-58(78)42(2)64-4/h5-10,21-24,29-32,39-42,47-50,53-56,63-64H,11-20,25-28,33-38H2,1-4H3,(H,65,77)(H,66,78)(H,67,79)(H,68,80)/t41-,42-,47-,48-,49-,50-,53-,54-,55-,56-/m0/s1 InChi Key LGYDZXNSSLRFJS-IOQQVAQYSA-N Canonical SMILES CC(C(=O)NC1CCCCC2CCC(N2C1=O)C(=O)NC(C3=CC=CC=C3)C4=CN(N=N4)CCCCC5=CC=C(C=C5)CCCCN6C=C(N=N6)C(C7=CC=CC=C7)NC(=O)C8CCC9N8C(=O)C(CCCC9)NC(=O)C(C)NC)NC Isomeric SMILES C[C@@H](C(=O)N[C@H]1CCCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@@H](C3=CC=CC=C3)C4=CN(N=N4)CCCCC5=CC=C(C=C5)CCCCN6C=C(N=N6)[C@H](C7=CC=CC=C7)NC(=O)[C@@H]8CC[C@H]9N8C(=O)[C@H](CCCC9)NC(=O)[C@H](C)NC)NC PubChem CID 17756618 Molecular Weight 1121.42
Certificates(CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Solubility (25°C) In vitro DMSO: 3 mg/mL (2.67 mM); Water: Insoluble; Ethanol: Insoluble;
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