Vitas-M small molecule compound

2-methoxy-5-[3-methoxy-2-(methoxycarbonyl)-3-oxoprop-1-en-1-yl]benzoic acid

Catalog ID
STL506555
SMILES COC(=O)C(=Cc1ccc(c(c1)C(=O)O)OC)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 C14H14O7 MW 294.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14O7/c1-19-11-5-4-8(6-9(11)12(15)16)7-10(13(17)20-2)14(18)21-3/h4-7H,1-3H3,(H,15,16)
InChIKey
XHPWVOZIPPPMOX-UHFFFAOYSA-N
Synonyms

2methoxy5(3methoxy2(methoxycarbonyl)3oxoprop1en1yl)benzoicacid
2METHOXY5(3METHOXY2METHOXYCARBONYL3OXOPROP1ENYL)BENZOICACID
869476
InChI=1SC14H14O7c11911548(69(11)12(15)16)710(13(17)202)14(18)213h47H13H3(H1516)
MFCD01442677
ZINC000005024217
ZINC5024217

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Available files

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