Vitas-M small molecule compound

methyl 3-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-methyl-4-oxo-2,3-dihydro-4H-furo[3,2-c]pyran-2-carboxylate

Catalog ID
STL434465
SMILES COC(=O)C1Oc2c(C1c1cc3OCOc3c(c1OC)OC)c(=O)oc(c2)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 C19H18O9 MW 390.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18O9/c1-8-5-10-13(18(20)27-8)12(16(28-10)19(21)24-4)9-6-11-15(26-7-25-11)17(23-3)14(9)22-2/h5-6,12,16H,7H2,1-4H3
InChIKey
OZKUYZSQQAXTKC-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C(C(O2)C(=O)OC)C3=CC4=C(C(=C3OC)OC)OCO4)C(=O)O1
InChI=1SC19H18O9c1851013(18(20)278)12(16(2810)19(21)244)961115(2672511)17(233)14(9)222h561216H7H214H3
methyl3(67dimethoxy13benzodioxol5yl)6methyl4oxo23dihydro4Hfuro(32c)pyran2carboxylate
methyl3(67dimethoxy13benzodioxol5yl)6methyl4oxo23dihydrofuro(32c)pyran2carboxylate
MFCD26098873
ZINC000085413673
ZINC000085413681

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Available files

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