Vitas-M small molecule compound

1,2,3,9,10-pentamethoxy-5H-isoindolo[2,1-a][3,1]benzoxazine-5,11(6aH)-dione

Catalog ID
STL526666
SMILES COc1cc2C(=O)OC3N(c2c(c1OC)OC)C(=O)c1c3ccc(c1OC)OC

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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 C20H19NO8 MW 401.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO8/c1-24-11-7-6-9-13(15(11)26-3)18(22)21-14-10(20(23)29-19(9)21)8-12(25-2)16(27-4)17(14)28-5/h6-8,19H,1-5H3
InChIKey
PJVFLFCIOGVIEJ-UHFFFAOYSA-N
Synonyms
370585-44-7
123910pentamethoxy5Hbenzo(45)(13)oxazino(23a)isoindole511(6aH)dione
123910pentamethoxy5Hisoindolo(21a)(31)benzoxazine511(6aH)dione
123910pentamethoxy6~(a)~(H)isoindolo(23a)(31)benzoxazine511dione
3278885
370585447
InChI=1SC20H19NO8c1241176913(15(11)263)18(22)211410(20(23)2919(9)21)812(252)16(274)17(14)285h6819H15H3
MFCD03006419
ZINC000002087498
ZINC000002087499

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.