Vitas-M small molecule compound
3-[8-acetyl-9-hydroxy-2-(3-methylbutyl)-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl]-4H-chromen-4-one
Catalog ID
STL549373
SMILES CC(CCn1cc2c3c1cccc3N=C1C(=C(O)N(C1)C(=O)C)C2c1coc2c(c1=O)cccc2)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 C29H27N3O4 MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O4/c1-16(2)11-12-31-13-19-25(20-15-36-24-10-5-4-7-18(24)28(20)34)27-22(14-32(17(3)33)29(27)35)30-21-8-6-9-23(31)26(19)21/h4-10,13,15-16,25,35H,11-12,14H2,1-3H3InChIKey
QSDRRTVDILSHQA-UHFFFAOYSA-NSynonyms
3(8acetyl9hydroxy2(3methylbutyl)27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)4Hchromen4one
InChI=1SC29H27N3O4c116(2)111231131925(201536241054718(24)28(20)34)2722(1432(17(3)33)29(27)35)302186923(31)26(19)21h4101315162535H111214H213H3
MFCD31756951
ZINC000888089944
ZINC000888089945
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Check stock on Vitas-MAvailable files
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