Vitas-M small molecule compound
1-[10-(1,3-benzodioxol-5-yl)-9-hydroxy-2-(2-methylpropyl)-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl]ethanone
Catalog ID
STL549345
SMILES CC(Cn1cc2c3c1cccc3N=C1C(=C(O)N(C1)C(=O)C)C2c1ccc2c(c1)OCO2)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 C26H25N3O4 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4/c1-14(2)10-28-11-17-23(16-7-8-21-22(9-16)33-13-32-21)25-19(12-29(15(3)30)26(25)31)27-18-5-4-6-20(28)24(17)18/h4-9,11,14,23,31H,10,12-13H2,1-3H3InChIKey
NJILEHJPYVRBED-UHFFFAOYSA-NSynonyms
1(10(13benzodioxol5yl)9hydroxy2(2methylpropyl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC26H25N3O4c114(2)1028111723(16782122(916)33133221)2519(1229(15(3)30)26(25)31)271854620(28)24(17)18h4911142331H101213H213H3
MFCD31756931
ZINC000888089888
ZINC000888089889
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