Vitas-M small molecule compound

methyl 4,6-dihydroxy-5-[3-methoxy-3-oxo-1-(3,4,5-trimethoxyphenyl)propyl]pyridine-3-carboxylate

Catalog ID
STL545581
SMILES COC(=O)CC(c1c(O)ncc(c1O)C(=O)OC)c1cc(OC)c(c(c1)OC)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 C20H23NO9 MW 421.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO9/c1-26-13-6-10(7-14(27-2)18(13)29-4)11(8-15(22)28-3)16-17(23)12(20(25)30-5)9-21-19(16)24/h6-7,9,11H,8H2,1-5H3,(H2,21,23,24)
InChIKey
DEMYATQMHSWBBW-UHFFFAOYSA-N
Synonyms
1676077-84-1
102565052
1676077841
InChI=1SC20H23NO9c12613610(714(272)18(13)294)11(815(22)283)1617(23)12(20(25)305)92119(16)24h67911H8H215H3(H2212324)
methyl46dihydroxy5(3methoxy3oxo1(345trimethoxyphenyl)propyl)pyridine3carboxylate
methyl4hydroxy5(3methoxy3oxo1(345trimethoxyphenyl)propyl)6oxo1~(H)pyridine3carboxylate
METHYL4HYDROXY5(3METHOXY3OXO1(345TRIMETHOXYPHENYL)PROPYL)6OXO16DIHYDROPYRIDINE3CARBOXYLATE
MFCD31756257
ZINC000218094415
ZINC000218094487

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Available files

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