Vitas-M small molecule compound
methyl 4-[8-acetyl-9-hydroxy-2-(2-methylpropyl)-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl]benzoate
Catalog ID
STL550324
SMILES COC(=O)c1ccc(cc1)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 C27H27N3O4 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O4/c1-15(2)12-29-13-19-23(17-8-10-18(11-9-17)27(33)34-4)25-21(14-30(16(3)31)26(25)32)28-20-6-5-7-22(29)24(19)20/h5-11,13,15,23,32H,12,14H2,1-4H3InChIKey
LUIRCWHXVMRPKP-UHFFFAOYSA-NSynonyms
InChI=1SC27H27N3O4c115(2)1229131923(1781018(11917)27(33)344)2521(1430(16(3)31)26(25)32)282065722(29)24(19)20h51113152332H1214H214H3
methyl4(8acetyl9hydroxy2(2methylpropyl)27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)benzoate
MFCD31757522
ZINC000888088686
ZINC000888088687
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