Vitas-M small molecule compound
1-{9-hydroxy-2-methyl-10-[4-(octyloxy)phenyl]-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl}ethanone
Catalog ID
STL549612
SMILES CCCCCCCCOc1ccc(cc1)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)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 C30H35N3O3 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O3/c1-4-5-6-7-8-9-17-36-22-15-13-21(14-16-22)27-23-18-32(3)26-12-10-11-24(28(23)26)31-25-19-33(20(2)34)30(35)29(25)27/h10-16,18,27,35H,4-9,17,19H2,1-3H3InChIKey
PQVOCXSRUAIPHG-UHFFFAOYSA-NSynonyms
1(9hydroxy2methyl10(4(octyloxy)phenyl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC30H35N3O3c1456789173622151321(141622)27231832(3)2612101124(28(23)26)31251933(20(2)34)30(35)29(25)27h1016182735H491719H213H3
MFCD31757093
ZINC000888088751
ZINC000888088752
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