Vitas-M small molecule compound

methyl 4-[(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-methoxyethyl)-4,5-dioxopyrrolidin-2-yl]benzoate

Catalog ID
STL052832
SMILES COCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)C(=O)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 C24H23NO8 MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO8/c1-30-10-9-25-20(14-3-5-15(6-4-14)24(29)31-2)19(22(27)23(25)28)21(26)16-7-8-17-18(13-16)33-12-11-32-17/h3-8,13,20,26H,9-12H2,1-2H3/b21-19+
InChIKey
PGCYODCIHLEOEM-XUTLUUPISA-N
Synonyms

COCCN1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1ccc(cc1)C(=O)OC
COCCN1C(C(=C(C2=CC3=C(C=C2)OCCO3)O)C(=O)C1=O)C4=CC=C(C=C4)C(=O)OC
InChI=1SC24H23NO8c1301092520(143515(6414)24(29)312)19(22(27)23(25)28)21(26)16781718(1316)3312113217h38132026H912H212H3b2119+
methyl4((3E)3(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(2methoxyethyl)45dioxopyrrolidin2yl)benzoate
MFCD05730075
ZINC000102890355
ZINC000102890358

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Available files

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