Vitas-M small molecule compound
1-[9-hydroxy-10-(4-methoxynaphthalen-1-yl)-2-(propan-2-yl)-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl]ethanone
Catalog ID
STL547931
SMILES COc1ccc(c2c1cccc2)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)C(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 C29H27N3O3 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3/c1-16(2)31-14-21-26(20-12-13-25(35-4)19-9-6-5-8-18(19)20)28-23(15-32(17(3)33)29(28)34)30-22-10-7-11-24(31)27(21)22/h5-14,16,26,34H,15H2,1-4H3InChIKey
NXOZMKFLJSCXQQ-UHFFFAOYSA-NSynonyms
1(9hydroxy10(4methoxynaphthalen1yl)2(propan2yl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC29H27N3O3c116(2)31142126(20121325(354)19965818(19)20)2823(1532(17(3)33)29(28)34)30221071124(31)27(21)22h514162634H15H214H3
MFCD31756664
ZINC000409414093
ZINC000409414094
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.