Vitas-M small molecule compound

methyl 4,6-dihydroxy-5-[3-methoxy-1-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-3-oxopropyl]pyridine-3-carboxylate

Catalog ID
STL543932
SMILES COC(=O)CC(c1c(O)ncc(c1O)C(=O)OC)c1cc(OC)c2c(c1)OCCO2

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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 C20H21NO9 MW 419.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO9/c1-26-13-6-10(7-14-18(13)30-5-4-29-14)11(8-15(22)27-2)16-17(23)12(20(25)28-3)9-21-19(16)24/h6-7,9,11H,4-5,8H2,1-3H3,(H2,21,23,24)
InChIKey
NOCRXLDIBZMURY-UHFFFAOYSA-N
Synonyms
1676077-74-9
102565119
1676077749
InChI=1SC20H21NO9c12613610(71418(13)30542914)11(815(22)272)1617(23)12(20(25)283)92119(16)24h67911H458H213H3(H2212324)
methyl46dihydroxy5(3methoxy1(8methoxy23dihydro14benzodioxin6yl)3oxopropyl)pyridine3carboxylate
methyl4hydroxy5(3methoxy1(5methoxy23dihydro14benzodioxin7yl)3oxopropyl)6oxo1~(H)pyridine3carboxylate
METHYL4HYDROXY5(3METHOXY1(8METHOXY23DIHYDROBENZO(B)(14)DIOXIN6YL)3OXOPROPYL)6OXO16DIHYDROPYRIDINE3CARBOXYLATE
MFCD31755945
ZINC000218111449
ZINC000218111524

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Available files

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