Vitas-M small molecule compound
3-[8-acetyl-9-hydroxy-2-(2-methylpropyl)-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl]-6-methoxy-4H-chromen-4-one
Catalog ID
STL550996
SMILES COc1ccc2c(c1)c(=O)c(co2)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 C29H27N3O5 MW 497.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O5/c1-15(2)11-31-12-19-25(20-14-37-24-9-8-17(36-4)10-18(24)28(20)34)27-22(13-32(16(3)33)29(27)35)30-21-6-5-7-23(31)26(19)21/h5-10,12,14-15,25,35H,11,13H2,1-4H3InChIKey
WOUKMKFUXMENNF-UHFFFAOYSA-NSynonyms
3(8acetyl9hydroxy2(2methylpropyl)27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)6methoxy4Hchromen4one
InChI=1SC29H27N3O5c115(2)1131121925(201437249817(364)1018(24)28(20)34)2722(1332(16(3)33)29(27)35)302165723(31)26(19)21h5101214152535H1113H214H3
MFCD31757890
ZINC000888090396
ZINC000888090397
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