Vitas-M small molecule compound
methyl {5-[8-acetyl-9-hydroxy-2-(2-methylpropyl)-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl]-2-methoxyphenoxy}acetate
Catalog ID
STL550526
SMILES COC(=O)COc1cc(ccc1OC)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)CC(C)C)C(=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H31N3O6 MW 517.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O6/c1-16(2)12-31-13-19-26(18-9-10-23(36-4)24(11-18)38-15-25(34)37-5)28-21(14-32(17(3)33)29(28)35)30-20-7-6-8-22(31)27(19)20/h6-11,13,16,26,35H,12,14-15H2,1-5H3InChIKey
ADPKUEMIONWPQY-UHFFFAOYSA-NSynonyms
InChI=1SC29H31N3O6c116(2)1231131926(1891023(364)24(1118)381525(34)375)2821(1432(17(3)33)29(28)35)302076822(31)27(19)20h61113162635H121415H215H3
methyl(5(8acetyl9hydroxy2(2methylpropyl)27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)2methoxyphenoxy)acetate
MFCD31757633
ZINC000888088970
ZINC000888088971
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.