Vitas-M small molecule compound
1-[10-(3,4-dimethoxyphenyl)-9-hydroxy-2-(2-methylpropyl)-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl]ethanone
Catalog ID
STL549332
SMILES 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 C27H29N3O4 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4/c1-15(2)12-29-13-18-24(17-9-10-22(33-4)23(11-17)34-5)26-20(14-30(16(3)31)27(26)32)28-19-7-6-8-21(29)25(18)19/h6-11,13,15,24,32H,12,14H2,1-5H3InChIKey
QUUXQJYSBPCBNM-UHFFFAOYSA-NSynonyms
1(10(34dimethoxyphenyl)9hydroxy2(2methylpropyl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC27H29N3O4c115(2)1229131824(1791022(334)23(1117)345)2620(1430(16(3)31)27(26)32)281976821(29)25(18)19h61113152432H1214H215H3
MFCD31756921
ZINC000888089246
ZINC000888089247
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